input word = C00042282

Metabolite InformationStructural formula
Name Betulifol B
(+)-Betulifol B
Formula C28H24O8
Mw 488.14711774
CAS RN 219761-18-9
C_ID C00042282 ,
InChIKey SQXOCQGZZNNSSQ-YSKNUQJSNA-N
InChICode InChI=1S/C28H24O8/c29-17-5-1-14(2-6-17)26(34)27(35)22-12-21(33)13-23-25(22)24(16-9-19(31)11-20(32)10-16)28(36-23)15-3-7-18(30)8-4-15/h1-13,24,26-35H/t24-,26+,27+,28+/m0/s1
SMILES c1c(cc2c(c1[C@H]([C@@H](c1ccc(cc1)O)O)O)[C@@H]([C@H](O2)c1ccc(cc1)O)c1cc(cc(c1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVitaceaeVitis betulifolia Ref.
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