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ellagitannin


Name(s) ellagitannin
Scientific name(s) galloyl 3-o,6-o-[(4,4',5,5',6,6'-hexahydroxy-1,1'-biphenyl)-2,2'-diylbiscarbonyl]-2-o,4-o-[[[(4as)-3,4,4a,9balpha-tetrahydro-3-oxo-4-(2-oxopropyl)-4beta,4aalpha,6,7-tetrahydroxydibenzofuran]-1,9-diyl]dicarbonyl]beta-d-glucopyranoside
Formula C44H32O27
Molecular mass 992.713
IUPAC name [(8R,9S,27R,29S,30R,36R,37S,38S)-2,3,14,15,16,19,20,21,36,37-decahydroxy-6,11,24,32,35-pentaoxo-36-(2-oxopropyl)-7,10,25,28,31,40-hexaoxaoctacyclo[35.2.1.05,39.08,27.09,30.012,17.018,23.033,38]tetraconta-1(39),2,4,12,14,16,18,20,22,33-decaen-29-yl] 3,4,5-trihydroxybenzoate
INCHI InChI=1S/C44H32O27/c1-10(45)8-43(63)22(51)7-15-26-25-14(6-20(50)30(55)34(25)71-44(26,43)64)40(61)67-33-21-9-65-38(59)12-4-18(48)28(53)31(56)23(12)24-13(5-19(49)29(54)32(24)57)39(60)68-35(33)36(69-41(15)62)42(66-21)70-37(58)11-2-16(46)27(52)17(47)3-11/h2-7,21,26,33,35-36,42,46-50,52-57,63-64H,8-9H2,1H3/t21-,26-,33-,35+,36-,42+,43-,44+/m1/s1
SMILE Not available
CAS ID Not available
PubChem ID 10033935
DrugBank ID Not available
CHEBI ID Not available
Description Not available