input word = C00009248

Metabolite InformationStructural formula
Name Guibourtinidol-(4alpha->6)-catechin-8-carboxylic acid
Formula C31H26O12
Mw 590.1424263
CAS RN
C_ID C00009248 ,
InChIKey JAAVWQRRUMLFKG-VPDLGRGYNA-N
InChICode InChI=1S/C31H26O12/c32-14-4-1-12(2-5-14)29-27(39)22(16-7-6-15(33)10-21(16)42-29)23-25(37)17-11-20(36)28(13-3-8-18(34)19(35)9-13)43-30(17)24(26(23)38)31(40)41/h1-10,20,22,27-29,32-39H,11H2,(H,40,41)/t20-,22+,27+,28-,29-/m1/s1
SMILES O=C(O)c1c(O)c([C@@H]2c3ccc(O)cc3O[C@H](c3ccc(O)cc3)[C@H]2O)c(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@@H](O)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAcacia luederitzii Ref.
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