input word = C00008873

Metabolite InformationStructural formula
Name Catechin 3'-O-gallate
Formula C22H18O10
Mw 442.0899968
CAS RN 110801-35-9
C_ID C00008873 ,
InChIKey GNXIIYFUGQWDJG-AURADERDNA-N
InChICode InChI=1S/C22H18O10/c23-11-6-14(25)12-8-17(28)21(31-18(12)7-11)9-1-2-13(24)19(5-9)32-22(30)10-3-15(26)20(29)16(27)4-10/h1-7,17,21,23-29H,8H2/t17-,21+/m0/s1
SMILES O=C(Oc1cc([C@H]2Oc3cc(O)cc(O)c3C[C@@H]2O)ccc1O)c1cc(O)c(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAcacia gerrardii Ref.
--Pithecolobium lobatum Ref.
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