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Epicatechin 3-O-gallate-(4beta->8)-epigallocatechin 3-O-gallate

PropertiesImageOccurences in reactions
MNX_IDMNXM125292Image of MNXM125292
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC44H34O21
charge0
mass898.15926
referencehmdb:HMDB0039304
InChIKeyFUNWNVWJOMCWIL-WZPNJOEPSA-N
InChIInChI=1S/C44H34O21/c45-18-10-23(49)33-31(11-18)62-40(14-1-2-20(46)22(48)3-14)42(65-44(61)17-8-29(55)38(59)30(56)9-17)35(33)34-24(50)13-21(47)19-12-32(63-43(60)16-6-27(53)37(58)28(54)7-16)39(64-41(19)34)15-4-25(51)36(57)26(52)5-15/h1-11,13,32,35,39-40,42,45-59H,12H2/t32-,35-,39-,40-,42-/m1/s1
SMILESO=C(O[C@@H]1Cc2c(O)cc(O)c([C@H]3c4c(O)cc(O)cc4O[C@H](c4ccc(O)c(O)c4)[C@@H]3OC(=O)c3cc(O)c(O)c(O)c3)c2O[C@@H]1c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1
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Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0039304 Epicatechin 3-O-gallate-(4beta->8)-epigallocatechin 3-O-gallate
(2R,3R)-8-[(2R,3R,4R)-2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyloxy)-3,4-dihydro-2H-1-benzopyran-4-yl]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoic acid
(2R,3R,4R)-4-[(2R,3R)-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyloxy)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-8-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate
3-O-Galloylepicatechin-(4beta->8)-epigallocatechin-3-O-gallate
Epicatechin 3-O-gallate(4b->8)epigallocatechin-3-O-gallate
Epicatechin 3-O-gallate-(4b->8)-epigallocatechin 3-O-gallate
Epicatechin 3-O-gallic acid-(4b->8)-epigallocatechin 3-O-gallic acid
Epicatechin 3-O-gallic acid-(4beta->8)-epigallocatechin 3-O-gallic acid
hmdb:HMDB39304 secondary/obsolete/fantasy identifier