input word = C00002906

Metabolite InformationStructural formula
Name Afzelechin-(4alpha->8)-afzelechin
Formula C30H26O10
Mw 546.15259705
CAS RN 101339-37-1
C_ID C00002906 ,
InChIKey JESPWQGCCOLVKQ-KJNMLZBZNA-N
InChICode InChI=1S/C30H26O10/c31-15-5-1-13(2-6-15)28-22(37)11-18-19(34)12-21(36)25(30(18)40-28)26-24-20(35)9-17(33)10-23(24)39-29(27(26)38)14-3-7-16(32)8-4-14/h1-10,12,22,26-29,31-38H,11H2/t22-,26-,27-,28+,29+/m0/s1
SMILES c1(cc2c(c(c1)O)[C@H]([C@@H]([C@H](O2)c1ccc(cc1)O)O)c1c(cc(c2c1O[C@@H]([C@H](C2)O)c1ccc(cc1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRhizophoraceaeKandelia candel Ref.
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OrganismKandelia candel
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter45