Name(s) |
uralsaponin s |
Scientific name(s) |
unii-c9hp2s2ftv; c9hp2s2ftv; chembl3314499; 3beta-o-(alpha-lrhamnopyranosyl-(1->2)-beta-d-glucopyranosyl-(1->2)-beta-d-glucuronopyranosyl)-21alpha-hydroxy-11-oxo-olean-12-en-30-oic acid; beta-d-glucopyranosiduronic acid, (3beta,20beta,21alpha)-20-carboxy-21-hydroxy-11-oxo-30-norolean-12-en-3-yl o-6-deoxy-alpha-l-mannopyranosyl-(1->2)-o-beta-d-glucopyranosyl-(1->2)- |
Formula |
C48H74O20 |
Molecular mass |
971.1 |
IUPAC name |
(2S,3S,4S,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,10R,11R,12aR,14aR,14bS)-11-carboxy-10-hydroxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-5-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid |
INCHI |
InChI=1S/C48H74O20/c1-19-27(52)29(54)33(58)39(63-19)67-35-30(55)28(53)23(18-49)64-40(35)68-36-32(57)31(56)34(38(59)60)66-41(36)65-26-10-11-45(5)24(43(26,2)3)9-12-48(8)37(45)22(50)15-20-21-16-46(6,42(61)62)25(51)17-44(21,4)13-14-47(20,48)7/h15,19,21,23-37,39-41,49,51-58H,9-14,16-18H2,1-8H3,(H,59,60)(H,61,62)/t19-,21-,23+,24-,25+,26-,27-,28+,29+,30-,31-,32-,33+,34-,35+,36+,37+,39-,40-,41+,44-,45-,46+,47+,48+/m0/s1 |
SMILE |
Not available |
CAS ID |
1616062-84-0 |
PubChem ID |
118707636 |
DrugBank ID |
Not available |
CHEBI ID |
Not available |