CHEBI:173295 - ent-Epicatechin-(4alpha->6)-ent-epicatechin

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name ent-Epicatechin-(4alpha->6)-ent-epicatechin
ChEBI ID CHEBI:173295
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C30H26O12
Net Charge 0
Average Mass 578.526
Monoisotopic Mass 578.14243
InChI InChI=1S/C30H26O12/c31-13-7-19(36)24-23(8-13)42-30(12-2-4-16(33)18(35)6-12)28(40)26(24)25-20(37)10-22-14(27(25)39)9-21(38)29(41-22)11-1-3-15(32)17(34)5-11/h1-8,10,21,26,28-40H,9H2
InChIKey GMISZFQPFDAPGI-UHFFFAOYSA-N
SMILES O1C(C(O)C(C2=C(O)C=3CC(O)C(OC3C=C2O)C4=CC(O)=C(O)C=C4)C=5C1=CC(O)=CC5O)C6=CC(O)=C(O)C=C6
ChEBI Ontology
Outgoing ent-Epicatechin-(4alpha->6)-ent-epicatechin (CHEBI:173295) is a flavonoid oligomer (CHEBI:72720)
IUPAC Name
2-(3,4-dihydroxyphenyl)-6-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
Manual Xrefs Databases
10673608 ChemSpider
HMDB0041239 HMDB
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