CHEBI:75211 - tannic acid

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ChEBI Name tannic acid
ChEBI ID CHEBI:75211
Definition A gallotannin obtained by acylation of the five hydroxy groups of D-glucose by 3,4-dihydroxy-5-[(3,4,5-trihydroxybenzoyl)oxy]benzoic acid (a gallic acid dimer).
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C76H52O46
Net Charge 0
Average Mass 1701.19850
Monoisotopic Mass 1700.17297
InChI InChI=1S/C76H52O46/c77-32-1-22(2-33(78)53(32)92)67(103)113-47-16-27(11-42(87)58(47)97)66(102)112-21-52-63(119-72(108)28-12-43(88)59(98)48(17-28)114-68(104)23-3-34(79)54(93)35(80)4-23)64(120-73(109)29-13-44(89)60(99)49(18-29)115-69(105)24-5-36(81)55(94)37(82)6-24)65(121-74(110)30-14-45(90)61(100)50(19-30)116-70(106)25-7-38(83)56(95)39(84)8-25)76(118-52)122-75(111)31-15-46(91)62(101)51(20-31)117-71(107)26-9-40(85)57(96)41(86)10-26/h1-20,52,63-65,76-101H,21H2/t52-,63-,64+,65-,76?/m1/s1
InChIKey LRBQNJMCXXYXIU-YIILYMKVSA-N
SMILES Oc1cc(cc(O)c1O)C(=O)Oc1cc(cc(O)c1O)C(=O)OC[C@H]1OC(OC(=O)c2cc(O)c(O)c(OC(=O)c3cc(O)c(O)c(O)c3)c2)[C@H](OC(=O)c2cc(O)c(O)c(OC(=O)c3cc(O)c(O)c(O)c3)c2)[C@@H](OC(=O)c2cc(O)c(O)c(OC(=O)c3cc(O)c(O)c(O)c3)c2)[C@@H]1OC(=O)c1cc(O)c(O)c(OC(=O)c2cc(O)c(O)c(O)c2)c1
Roles Classification
Biological Role(s): carcinogenic agent
A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application(s): geroprotector
Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.
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 tannic acid (CHEBI:75211) has functional parent gallic acid (CHEBI:30778)
tannic acid (CHEBI:75211) has role carcinogenic agent (CHEBI:50903)
tannic acid (CHEBI:75211) has role geroprotector (CHEBI:176497)
tannic acid (CHEBI:75211) has role metabolite (CHEBI:25212)
tannic acid (CHEBI:75211) is a D-glucoside (CHEBI:35436)
tannic acid (CHEBI:75211) is a gallotannin (CHEBI:24182)
tannic acid (CHEBI:75211) is a monosaccharide derivative (CHEBI:63367)
IUPAC Name
1,2,3,4,6-pentakis-O-{3,4-dihydroxy-5-[(3,4,5-trihydroxybenzoyl)oxy]benzoyl}-D-glucopyranose
Manual Xrefs Databases
C13452 KEGG COMPOUND
CPD-17778 MetaCyc
D01959 KEGG DRUG
DB09372 DrugBank
FDB001111 FooDB
HMDB0258711 HMDB
Tannic_acid Wikipedia
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Registry Numbers Types Sources
1401-55-4 CAS Registry Number ChemIDplus
8186386 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
21805983 PubMed citation Europe PMC
22114686 PubMed citation Europe PMC
23583842 PubMed citation Europe PMC
23776675 PubMed citation Europe PMC
Last Modified
28 October 2021