input word = C00009276

Metabolite InformationStructural formula
Name Proanthocyanidin A6
Formula C30H24O12
Mw 576.12677623
CAS RN 114569-31-2
C_ID C00009276 ,
InChIKey BEPYKTSNKZMROV-OJDYYSGKNA-N
InChICode InChI=1S/C30H24O12/c31-13-7-19(36)24-22(8-13)41-30(12-2-4-16(33)18(35)6-12)29(39)26(24)25-23(42-30)10-21-14(27(25)38)9-20(37)28(40-21)11-1-3-15(32)17(34)5-11/h1-8,10,20,26,28-29,31-39H,9H2/t20-,26-,28-,29-,30+/m1/s1
SMILES c1c(cc(c2c1O[C@@]1([C@@H]([C@H]2c2c(O1)cc1c(c2O)C[C@H]([C@H](O1)c1ccc(c(c1)O)O)O)O)c1ccc(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeParameria laevigata MOLDENKE Ref.
PlantaeSapindaceaeAesculus hippocastanum Ref.
zoom in