CHEBI:81231 - Cinnamtannin D2

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ChEBI Name Cinnamtannin D2
ChEBI ID CHEBI:81231
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C60H48O24
Net Charge 0
Average Mass 1153.00870
Monoisotopic Mass 1152.25355
InChI InChI=1S/C60H48O24/c61-23-13-34(71)42-40(14-23)80-54(20-2-6-26(63)31(68)10-20)51(77)48(42)45-36(73)17-37(74)46-50-47-41(83-60(59(50)79,84-58(45)46)22-4-8-28(65)33(70)12-22)18-38(75)44-49(52(78)55(82-57(44)47)21-3-7-27(64)32(69)11-21)43-35(72)16-29(66)24-15-39(76)53(81-56(24)43)19-1-5-25(62)30(67)9-19/h1-14,16-18,39,48-55,59,61-79H,15H2/t39-,48+,49-,50+,51+,52+,53+,54+,55+,59+,60+/m0/s1
InChIKey QRQAODSINXAOBF-BITWWPEZSA-N
SMILES O[C@H]1Cc2c(O)cc(O)c([C@@H]3[C@@H](O)[C@H](Oc4c3c(O)cc3O[C@@]5(Oc6c([C@@H]7[C@@H](O)[C@H](Oc8cc(O)cc(O)c78)c7ccc(O)c(O)c7)c(O)cc(O)c6[C@@H]([C@H]5O)c43)c3ccc(O)c(O)c3)c3ccc(O)c(O)c3)c2O[C@@H]1c1ccc(O)c(O)c1
Roles Classification
Application(s): astringent
A compound that causes the contraction of body tissues, typically used to reduce bleeding from minor abrasions.
(via tannin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Cinnamtannin D2 (CHEBI:81231) is a proanthocyanidin (CHEBI:26267)
Manual Xrefs Databases
C17633 KEGG COMPOUND
HMDB0037669 HMDB
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