input word = C00009277

Metabolite InformationStructural formula
Name Proanthocyanidin A1
Formula C30H24O12
Mw 576.12677623
CAS RN 103883-03-0
C_ID C00009277 ,
InChIKey NSEWTSAADLNHNH-YWEQTYSCNA-N
InChICode InChI=1S/C30H24O12/c31-13-7-20(37)24-22(8-13)41-30(12-2-4-16(33)19(36)6-12)29(39)26(24)25-23(42-30)10-17(34)14-9-21(38)27(40-28(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,21,26-27,29,31-39H,9H2/t21-,26+,27-,29+,30-/m0/s1
SMILES c1c(cc(c2c1O[C@@]1([C@@H]([C@H]2c2c(O1)cc(c1c2O[C@H]([C@H](C1)O)c1cc(c(cc1)O)O)O)O)c1ccc(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeEcdysanthera utilis Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia mangostana Ref.
PlantaeEricaceaeVaccinium vitis-idaea Ref.
PlantaeFabaceaeArachis hypogaea L. Ref.
PlantaeFabaceaeLupinus angustifolius Ref.
PlantaeIlliciaceaeIllicium anisatum Ref.
PlantaeLauraceaeCinnamomum aromaticum Ref.
PlantaeLauraceaeCinnamomum spp. Ref.
PlantaeLauraceaePersea gratissima Ref.
PlantaeMalvaceaeCola acuminata Ref.
PlantaeMalvaceaeTheobroma cacao L. Ref.
PlantaePalmaeAreca catechu Ref.
PlantaeSapindaceaeAesculus hippocastanum Ref.
zoom in



OrganismCinnamomum spp.
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 355,Flavans and proanthocyanidins

Weinges,Ann.,711,(1968),184

Nonaka,Chem.Pharm.Bull.,35,(1987),149