input word = C00009070

Metabolite InformationStructural formula
Name Procyanidin B6
Catechin-(4alpha->6)-catechin
Formula C30H26O12
Mw 578.1424263
CAS RN 12798-58-2
C_ID C00009070 ,
InChIKey GMISZFQPFDAPGI-VUEAOWRWNA-N
InChICode InChI=1S/C30H26O12/c31-13-7-19(36)24-23(8-13)42-30(12-2-4-16(33)18(35)6-12)28(40)26(24)25-20(37)10-22-14(27(25)39)9-21(38)29(41-22)11-1-3-15(32)17(34)5-11/h1-8,10,21,26,28-40H,9H2/t21-,26+,28-,29+,30+/m0/s1
SMILES c1c(ccc(c1O)O)[C@H]1Oc2c(C[C@@H]1O)c(c(c(c2)O)[C@@H]1[C@@H]([C@H](Oc2c1c(cc(c2)O)O)c1ccc(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBetulaceaeBetula spp. Ref.
PlantaeEricaceaeVaccinium vitis-idaea Ref.
PlantaeFagaceaeQuercus miyagii Ref.
PlantaePinaceaePicea abies Ref.
PlantaePinaceaePinus radiata Ref.
PlantaePinaceaePinus sylvestris Ref.
PlantaeRosaceaeFragaria spp. Ref.
PlantaeRosaceaeRosa cymosa Ref.
PlantaeSalicaceaeSalix spp. Ref.
PlantaeVitaceaeVitis vinifera Ref.
zoom in



OrganismPinus sylvestris
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 355,Flavans and proanthocyanidins

Fletcher,J.Chem.Soc.Perkin Trans.,1,(1977),1628