input word = C00008876

Metabolite InformationStructural formula
Name Catechin 3,7,-di-O-galate
Formula C29H22O14
Mw 594.10095541
CAS RN 128397-04-6
C_ID C00008876 ,
InChIKey CGOZIOXIWGDPED-IZZVQOSMNA-N
InChICode InChI=1S/C29H22O14/c30-16-2-1-11(3-18(16)32)27-24(43-29(40)13-6-21(35)26(38)22(36)7-13)10-15-17(31)8-14(9-23(15)42-27)41-28(39)12-4-19(33)25(37)20(34)5-12/h1-9,24,27,30-38H,10H2/t24-,27+/m0/s1
SMILES O=C(Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@@H](OC(=O)c1cc(O)c(O)c(O)c1)C2)c1cc(O)c(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAcacia gerrardii Ref.
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