input word = C00047752

Metabolite InformationStructural formula
Name Berbekorin A
Formula C24H26O8
Mw 442.16276781
CAS RN 1189131-96-1
C_ID C00047752 ,
InChIKey LXYLAIPUYRMIPU-LQPSJYAFNA-N
InChICode InChI=1S/C24H26O8/c1-29-18-9-15(14-7-5-4-6-8-14)10-19(23(18)28)32-24-20(30-2)11-16(12-21(24)31-3)22(27)17(26)13-25/h4-12,17,22,25-28H,13H2,1-3H3/t17-,22-/m1/s1
SMILES COc1cc(-c2ccccc2)cc(Oc2c(OC)cc([C@@H](O)[C@H](O)CO)cc2OC)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBerberidaceaeBerberis koreana Ref.
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