input word = C00009074

Metabolite InformationStructural formula
Name Procyanidin B7
Catechin-(4beta->6)-catechin
Formula C30H26O12
Mw 578.1424263
CAS RN 12798-59-3
C_ID C00009074 ,
InChIKey GMISZFQPFDAPGI-FGJLFUJHNA-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
PlantaeCistaceaeCistus incanus Ref.
PlantaeEricaceaeVaccinium vitis-idaea Ref.
PlantaeFagaceaeQuercus miyagii Ref.
PlantaeFagaceaeQuercus petraea Ref.
PlantaeIlliciaceaeIllicium anisatum Ref.
PlantaeLauraceaeCinnamomum cassia Blume. Ref.
PlantaeLauraceaeCinnamomum comphora Ref.
PlantaeLauraceaeCinnamomum obtusifolium Nees. Ref.
PlantaeLauraceaeLaurus nobilis Ref.
PlantaePalmaeAreca catechu Ref.
PlantaePinaceaePinus taeda Ref.
PlantaePolygonaceaeRheum sp. Ref.
PlantaeSalicaceaeSalix caprea Ref.
PlantaeSalicaceaeSalix sieboldiana Ref.
PlantaeVitaceaeVitis vinifera Ref.
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