Compounds
No. Name(s) Scientific name(s)
COMP-002001 (-)-delta-cadinene (1r,8as)-4,7-dimethyl-1-(propan-2-yl)-1,2,3,5,6,8a-hexahydronaphthalene; (1r,8as)-4,7-dimethyl-1-isopropyl-1,2,3,5,6,8a-hexahydronaphthalene; .sigma.-cadinene; (?)-delta-cadinene; chebi:63703; c20182; q27132741
COMP-002002 mandelic acid dl-mandelic acid; 2-hydroxy-2-phenylacetic acid; 611-72-3; phenylglycolic acid; amygdalic acid; almond acid
COMP-002003 (+)-isolongifolene-9-one
COMP-002004 aspartic acid
COMP-002005 (3s,4s,5r,6r)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol d-tal; d-talopyranose; d-talopyranoside; d-talose; tal; talopyranose; talopyranoside
COMP-002006 3',4',7-trimethylquercetin
COMP-002007 patchoulenone
COMP-002008 polaramycin a
COMP-002009 6-deoxyglucose (2r,3s,4r,5r)-2,3,4,5-tetrahydroxyhexanal; unii-o654621e3t; o654621e3t; 3615-41-6; aldehydo-d-quinovose; 6dog
COMP-002010 (2s)-2-hydroxy-2-phenylacetic acid (s)-(+)-mandelic acid; (s)-mandelic acid; l-mandelic acid; (s)-2-hydroxy-2-phenylacetic acid; l-(+)-mandelic acid; s-(+)-mandelic acid
COMP-002011 diapolycopendial 4,4'-diapolycopenedial; diapolycopenedial; 4,4'-diapolycopene dialdehyde; 4,4'-diapo-psi,psi-carotenedial; (2e,4e,6e,8e,10e,12e,14e,16e,18e,20e,22e)-2,6,10,15,19,23-hexamethyltetracosa-2,4,6,8,10,12,14,16,18,20,22-undecaenedial; (all-e)-2,6,10,15,19,23-hexamethyltetracosa-2,4,6,8,10,12,14,16,18,20,22-undecaenedial; schembl2832986
COMP-002012 4-aromadendrene 1h-cycloprop[e]azulene, 1a,2,3,4,4a,5,6,7b-octahydro-1,1,4,7-tetramethyl-, [1ar-(1a.alpha.,4.alpha.,4a.beta.,7b.alpha.)]-; 1h-cycloprop[e]azulene, 1a.beta.,2,3,4,4a.alpha.,5,6,7b.beta.-octahydro-1,1,4.beta.,7-tetramethyl-; .alpha.-gurjunene; 1h-cycloprop[e]azulene, 1a,2,3,4,4a,5,6,7b-octahydro-1,1,4,7-tetramethyl-, (1ar,4r,4ar,7bs)-; 1-epi-a-gurjunene; 1-epi-alpha-gurjunene
COMP-002013 acefylline theophylline-7-acetic acid; acephylline; theophyllineacetic acid; carboxymethyltheophylline; theophyllin-7-ylacetic acid; 7-(carboxymethyl)theophylline
COMP-002014 crenatoside chembl451273; c10481; bdbm50143049; oraposide; orobanchoside
COMP-002015 l-leucine, (s)- nsc225221; n,n'-bis(l-carboxyisobutylmethyl)benzamidine; nsc-225221; wln: 1y1&1yvqnuyr&myvq1y1&1 -l; benzamidine,n'-bis(l-carboxyisobutylmethyl)-
COMP-002016 2-amino-2-methyl-1,3-propandiol 2-amino-2-methyl-1,3-propanediol; 2-amino-2-methylpropane-1,3-diol; ampd; aminoglycol; aminomethyl propanediol; 1,3-propanediol, 2-amino-2-methyl-
COMP-002017 eriodictyol 7,3'-dimethyl ether
COMP-002018 xylitol; ribitol ribitol; adonitol; 488-81-3; xylite; d-xylitol; adonite
COMP-002019 7,3',4'-tri-o-methylluteolin
COMP-002020 galactaric acid; mucic acid mucic acid; saccharolactic acid; (2r,3s,4r,5s)-2,3,4,5-tetrahydroxyhexanedioic acid; d-galactaric acid; galactarate; galactosaccharic acid; saccharolactate
COMP-002021 acetoside; verbascoside; acteoside acteoside; verbascoside; kusaginin; verbacoside; tjc 160; unii-3tgx09bd5b
COMP-002022 dehydroazukisaponin v
COMP-002023 (s)-2-amino-1-phenylethanol (1s)-2-amino-1-phenylethanol; (s)-(-)-2-phenylglycinol; mfcd00239405; (1s)-(+)-2-amino-1-phenylethan-1-ol; (s)-(+)-2-amino-1-phenylethanol; (s)-2-amino-1-phenylethan-1-ol
COMP-002024 1,2,3,4,5,6,7,8-octahydro-1alpha,4beta-dimethyl-7-(1-methylethylidene)azulene zinc2169363
COMP-002025 guaijaverin; guajaverin; guajavarin guajavarin; guajaverin; chembl464507; quercetin-3-arabinopyranoside; 30370-87-7; megxp0_000272; guaijaverin
COMP-002026 seychellene 1,6-methanonaphthalene, decahydro-1,4,8a-trimethyl-9-methylene-, (1s,4s,4as,6r,8as)-(-)-; ft-0777864; 1,6-methanonaphthalene, decahydro-1,4,8a-trimethyl-9-methylene-, *1s-(1.alpha.,4.alpha.,4a.beta.,6.alpha
COMP-002027 palatinose; isomaltulose isomaltulose; 6-o-alpha-d-glucopyranosyl-d-fructofuranose; isomaltulose hydrate; (2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-[[(2r,3s,4s)-3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]methoxy]oxane-3,4,5-triol; 58166-27-1; (2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-(((2r,3s,4s)-3,4,5-trihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)methoxy)tetrahydro-2h-pyran-3,4,5-triol; 15132-06-6; palatinose
COMP-002028 (r)-mandelic acid (r)-(-)-mandelic acid; (r)-2-hydroxy-2-phenylacetic acid; d-mandelic acid; d-(-)-mandelic acid; (-)-mandelic acid; d(-)-mandelic acid
COMP-002029 (r)-2-amino-1-phenylethanol (1r)-2-amino-1-phenylethanol; (r)-(-)-2-amino-1-phenylethanol; (r)-2-amino-1-phenylethan-1-ol; mfcd00239406; chembl19363; schembl147501
COMP-002030 iminodiacetic acid 2,2'-azanediyldiacetic acid; 2,2'-iminodiacetic acid; glycine, n-(carboxymethyl)-; aminodiacetic acid; iminobis(acetic acid); diglycocoll
COMP-002031 eriodictyol 7,3',4'-trimethyl ether
COMP-002032 widdrol
COMP-002033 serine
COMP-002034 l-mannitol (2s,3s,4s,5s)-hexane-1,2,3,4,5,6-hexaol; (2s,3s,4s,5s)-hexane-1,2,3,4,5,6-hexol; d-mannitol, ep, usp grade; c6h14o6; l-mitobronitol; schembl25330
COMP-002035 gluconolactone delta-gluconolactone; d-glucono-1,5-lactone; gluconic acid lactone; 1,5-gluconolactone; d-gluconolactone; d-gluconic acid lactone
COMP-002036 .gamma.-himachalene gamma-himachalene; 3,5,5,9-tetramethyl-2,4a,5,6,7,9a-hexahydro-1h-benzo[7]annulene; 2,5,9,9-tetramethyl-3,4,4a,7,8,9a-hexahydrobenzo[7]annulene; himachal-4,10-diene; g-himachalene; 2,7-himachaladiene; chebi:49224
COMP-002037 (+)-thujopsene (-)-thujopsene; cis-thujopsene; (1ar,4ar,8ar)-2,4a,8,8-tetramethyl-1,1a,4,4a,5,6,7,8-octahydrocyclopropa[d]naphthalene; (-)-thujopsen; chebi:61737; dtxsid50881245
COMP-002038 threitol d-threitol; 2418-52-2; (2r,3r)-butane-1,2,3,4-tetrol; d-threo-tetritol; unii-6dn82xbt5m; dl-threitol
COMP-002039 diphenyl sulfide phenyl sulfide; benzene, 1,1'-thiobis-; diphenyl sulphide; diphenylsulfane; phenylthiobenzene; diphenyl thioether
COMP-002040 isomaltose; (3r,4s,5s,6r)-6-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol brachiose; chebi:28189; mfcd00065373; 6-o-alpha-d-glucopyranosyl-d-glucopyranose; (3r,4s,5s,6r)-6-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol; smr000857202; isomaltose
COMP-002041 eridictiol diosmetin-7-o-beta-d-glucopyranoside; diosmetin 7-o-beta-d-glucopyranoside; diosmetol 7-glucoside; diosmetin-7-o-; a-d-glucopyranoside; diosmetin 7-o-glucoside
COMP-002042 melibiose gal-alpha(1,6)glc; 6-o-alpha-d-galactopyranosyl-d-glucopyranose; 6-o-(alpha-d-galactopyranosyl)-d-glucopyranose; d-gal-alpha1->6d-glucose; chebi:28053; alpha-d-gal-(1->6)-d-glc; alpha-d-galactosyl-(1->6)-d-glucose
COMP-002043 n-ethylglycine 2-(ethylamino)acetic acid; n-ethyl glycine; etgly; glycine, n-ethyl-; 2-ethylaminoacetic acid; n-ethylglycine, 98%
COMP-002044 3''-o-methylcrenatoside
COMP-002045 6 beta-galactinol
COMP-002046 1-hydroxy-2-naphthoic acid 1-hydroxynaphthalene-2-carboxylic acid; 1-naphthol-2-carboxylic acid; 2-carboxy-1-naphthol; 2-naphthalenecarboxylic acid, 1-hydroxy-; 1-hydroxy-2-naphthoate; 1-hydroxy-2-naphthalenecarboxylic acid
COMP-002047 soyasaponin i; soyasaponin 1 soyasaponin bb; soyasaponin 1; soyasaponinbb; scm 3b; soybean saponin fraction b1; chebi:9211
COMP-002048 4,4'-diapolycopenoic acid
COMP-002049 licoagrochacone a; licochalcone a licochalcone a; licochalcone-a; licochalconea; unii-jtv5467968; (e)-3-[4-hydroxy-2-methoxy-5-(2-methylbut-3-en-2-yl)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one; chembl139702
COMP-002050 6-deoxyhexose 2,3,4,5-tetrahydroxyhexanal; nsc2056; 6-deoxy-d-allose; isodulcitol; locaose; 75247-25-5
COMP-002051 methylmalonic acid 2-methylmalonic acid; 2-methylpropanedioic acid; isosuccinic acid; methylmalonate; propanedioic acid, methyl-; 1,1-ethanedicarboxylic acid
COMP-002052 trehalose dihydrate
COMP-002053 (+)-cyclosativene
COMP-002054 .alpha.-selinene naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethenyl)-, [2r-(2.alpha.,4a.alpha.,8a.beta.)]-; 2-isopropenyl-4a,8-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene #
COMP-002055 methyl oleanolate
COMP-002056 3,5-dihydroxy-4',7-dimethoxyflavone; 3,5-dihydroxy-7,4'-dimethoxyflavone 3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4h-chromen-4-one; 3,5-dihydroxy-7,4'-dimethoxyflavone; 3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)chromen-4-one; kaempferol 7,4'-dimethyl ether; 7,4'-dimethylkaempferol; 3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4-benzopyrone
COMP-002057 n-oleoylsarcosine 2-(n-methyloleamido)acetic acid; oleoyl sarcosine; oleyl sarcosine; unii-4011k1s96y; n-methyl-n-oleoylglycine; oleoylsarcosine
COMP-002058 valepotriate valtrate; valtratum; unii-l3jq035x9b; halazuchrome b; valtrato; valtrats
COMP-002059 nootkatene 5090-61-9
COMP-002060 (+)-.gamma.-gurjunene
COMP-002061 2,3-dihydroxypropanal dl-glyceraldehyde; glyceraldehyde; glyceric aldehyde; glycerose; propanal, 2,3-dihydroxy-; glycerinaldehyde
COMP-002062 7-trimethylkaempferol; kaempferol-3,7,4'-trimethyl ether kaempferol 3,7,4'-trimethyl ether; kaempferol trimethylether; kaempferol-3,7,4'-trimethyl ether; 5-hydroxy-3,7-dimethoxy-2-(4-methoxyphenyl)chromen-4-one; kaempferol 3,7,4'-trimethylether; kaempferol-3,7,4'-trimethylether
COMP-002063 3beta-[2-o-(2-o-alpha-l-rhamnopyranosyl-beta-d-galactopyranosyl)-beta-d-glucopyranuronosyloxy]-21alpha-(alpha-l-arabinopyranosyloxy)oleana-12-ene-22beta,24-diol
COMP-002064 isocrenatoside chembl402471; dtxsid70659483; bdbm50143048; nsc729650; nsc-729650; [(2s,4ar,6r,7r,8s,8ar)-2-(3,4-dihydroxyphenyl)-7-hydroxy-8-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}hexahydro-4ah-pyrano[2,3-b][1,4]dioxin-6-yl]methyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate (non-preferred name)
COMP-002065 (3r,4s)-2,5-dimethyl-3,4-hexanediol schembl13573065
COMP-002066 cyclohexanone, 2,3,3-trimethyl-2-(3-methyl-1,3-butadienyl)-, (e)-
COMP-002067 d-pipecolic acid (r)-piperidine-2-carboxylic acid; d-pipecolinic acid; d-homoproline; d(+)-pipecolinic acid; (2r)-piperidine-2-carboxylic acid; (d)-pipecolic acid
COMP-002068 alpha-isopropylmalate 2-isopropylmalic acid; 2-hydroxy-2-isopropylsuccinic acid; alpha-isopropylmalic acid; 2-hydroxy-2-propan-2-ylbutanedioic acid; 2-hydroxy-2-(1-methylethyl)butanedioic acid; 3-carboxy-3-hydroxyisocaproic acid
COMP-002069 cosmosiin 6''-(e)-p-coumarate
COMP-002070 diisooctyl phthalate; isooctyl phthalate bis(6-methylheptyl) phthalate; isooctyl phthalate; flexol plasticizer diop; phthalic acid, diisooctyl ester; 131-20-4; bis(6-methylheptyl) benzene-1,2-dicarboxylate
COMP-002071 (7r,11r)-3-methylene-7,11,15-trimethyl-1-hexadecene zinc28540996; unii-hl3qfb56fb component nidgcipamwnkoa-uxhiceinsa-n
COMP-002072 turanose 3-o-alpha-d-glucopyranosyl-d-fructose; turanose (van); d-(+)-turanose (van); unii-6d600ary3r; 6d600ary3r; d-fructose, 3-o-.alpha.-d-glucopyranosyl-; beta-turanose
COMP-002073 soyasaponin iii; soyasaponin ⅲ (3beta,4beta,21alpha)-21,23-dihydroxyolean-12-en-3-yl-2-o-beta-d-galactopyranosyl-beta-d-glucopyranosiduronic acid; (3beta,22beta)-22,24-dihydroxyolean-12-en-3-yl 2-o-beta-d-galactopyranosyl-beta-d-glucopyranosiduronic acid; chebi:62867; zinc95635627; c19865; q27132247
COMP-002074 l-fucose; fucose 6-deoxy-galactopyranose; 6-deoxy-galactopyranoside; 6-deoxy-galactose; 6-deoxy-l-galactopyranose; 6-deoxy-l-galactopyranoside; 6-deoxy-l-galactose; fuc
COMP-002075 gluconic acid d-gluconic acid; 526-95-4; dextronic acid; maltonic acid; glycogenic acid; (2r,3s,4r,5r)-2,3,4,5,6-pentahydroxyhexanoic acid; glosanto
COMP-002076 16462-44-5 cellobiose; cellose; d-cellobiose; d-(+)-cellobiose; beta-maltose; 4-o-beta-d-glucopyranosyl-d-glucopyranose; 1-beta-d-glucopyranosyl-4-d-glucopyranose
COMP-002077 cis-cinnamate
COMP-002078 d-aspartate; d-aspartic acid d-aspartic acid; (r)-2-aminosuccinic acid; h-d-asp-oh; (-)-aspartic acid; (2r)-2-aminobutanedioic acid; (r)-aspartic acid
COMP-002079 aristolone 25274-27-5; aristofone; (1ar,7r,7ar,7bs)-1,1,7,7a-tetramethyl-1a,4,5,6,7,7b-hexahydrocyclopropa[a]naphthalen-2-one; aristol-9-en-8-one; (?)-aristolone; chembl512374
COMP-002080 hydracrylic acid 3-hydroxypropionic acid; 3-hydroxypropanoic acid; hydroxypropionic acid; beta-hydroxypropionic acid; ethylene lactic acid; propanoic acid, 3-hydroxy-
COMP-002081 melezitose d-(+)-melezitose; melizitose; d-melezitose; unii-t4t25qn29l; melicitose; chebi:6731
COMP-002082 friedelinol; epifriedelanol friedelan-3-ol; epi-friedelinol; friedelanol; friedelan-3alpha-ol; (3r,4r,4as,6as,6as,6br,8ar,12ar,14as,14bs)-4,4a,6a,6b,8a,11,11,14a-octamethyl-1,2,3,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-hexadecahydropicen-3-ol; fridelinol; friedelan-3|a-ol; friedelinol;
COMP-002083 alpha-patchoulene
COMP-002084 4-amino-1h-imidazole-5-carboxamide 4-amino-5-imidazolecarboxamide; 5-aminoimidazole-4-carboxamide; 5-amino-1h-imidazole-4-carboxamide; 5-amino-4-imidazolecarboxamide; 21299-72-9; aica
COMP-002085 apigetrin; apigenin-7-o-glucoside; apigenin 7-glucoside; apigenin 7-o-glucoside cosmosiin; apigenin 7-glucoside; cosmosioside; cosmosiine; apigenin 7-o-beta-d-glucoside; apigenin-7-glucoside; apigetrin
COMP-002086 aciphyllene guaia-4,11-diene; 4,11(13)-guaiadiene; 5-isopropenyl-3,8-dimethyl-1,2,4,5,6,7,8,8a-octahydroazulene; q67879661; 5-isopropenyl-3,8-dimethyl-1,2,4,5,6,7,8,8a-octahydroazulene #; (5r,8s,8as)-3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,4,5,6,7,8,8a-octahydroazulene
COMP-002087 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid; 4-hydroxy-3-methoxymandelic acid; vanillylmandelic acid vanillylmandelic acid; dl-4-hydroxy-3-methoxymandelic acid; 4-hydroxy-3-methoxymandelic acid; vanilmandelic acid; 2394-20-9; (+/-)-vanillylmandelic acid
COMP-002088 lyxose d-lyx; d-lyxopyranose; d-lyxopyranoside; d-lyxose; lyx; lyxopyranose; lyxopyranoside
COMP-002089 soyasapogenol b monoglucuronide soyasapogenol b 3-o-beta-glucuronide; soyasapogenol b-3-o-glucuronide; soyasapogenol b-3-o-beta-glucuronide; chebi:62439; soyasapogenol b 3-o-d-glucuronide; soyasapogenol b 3-o-beta-d-glucuronide; c19763
COMP-002090 lactobionic acid 4-o-beta-d-galactopyranosyl-d-gluconic acid; unii-65r938s4dv; 4-(beta-d-galactosido)-d-gluconic acid; chebi:55481; 65r938s4dv; mfcd00078147
COMP-002091 3beta-(2-o-beta-d-galactopyranosyl-beta-d-glucopyranuronosyloxy)-21alpha-(alpha-l-rhamnopyranosyloxy)oleana-12-ene-22beta,24-diol
COMP-002092 maleamic acid maleamate; maleic monoamide; (z)-4-amino-4-oxobut-2-enoic acid; maleic acid monoamide; unii-mjs1dtx3x1; acrylic acid, 3-carbamoyl-, (z)-
COMP-002093 galactinol unii-wze56l8ukr; 1-alpha-d-galactosyl-myo-inositol; galactinol hydrate; wze56l8ukr; 1-o-alpha-d-galactosyl-d-myo-inositol; 3-o-alpha-d-galactopyranosyl-d-myo-inositol
COMP-002094 provitamin c
COMP-002095 guaiacylglycerol; erythro-guaiacylglycerol; threo-guaiacylglycerol alpha-guaiacylglycerol; 1-(4-hydroxy-3-methoxyphenyl)propane-1,2,3-triol; erythro-guaiacylglycerol; chebi:53663; 4-(1,2,3-trihydroxypropyl)-2-methoxyphenol; 1-(3-methoxy-4-hydroxyphenyl)-1,2,3-propanetriol
COMP-002096 irisolidone
COMP-002097 valencen 4a,5-dimethyl-3-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene; 4a,5-dimethyl-3-prop-1-en-2-yl-2,3,4,5,6,7-hexahydro-1h-naphthalene; oxo-tremorine; valencene 85; (+)-eremorphilene; 4.alpha.,9-octalin; 4.beta.h,11-diene
COMP-002098 flopropione 2',4',6'-trihydroxypropiophenone; phloropropiophenone; cospanon; argobyl; 1-(2,4,6-trihydroxyphenyl)propan-1-one; phloropropionone
COMP-002099 hispidacin
COMP-002100 nerolidol
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