input word = C00037263

Metabolite InformationStructural formula
Name Heraclenol 3'-O-beta-D-glucopyranoside
(+)-Heraclenol 3'-O-beta-D-glucopyranoside
Formula C22H26O11
Mw 466.14751167
CAS RN 32207-10-6
C_ID C00037263 ,
InChIKey CDKAMOZNCWECGP-OZOZWZNVNA-N
InChICode InChI=1S/C22H26O11/c1-22(2,33-21-17(28)16(27)15(26)12(8-23)31-21)13(24)9-30-20-18-11(5-6-29-18)7-10-3-4-14(25)32-19(10)20/h3-7,12-13,15-17,21,23-24,26-28H,8-9H2,1-2H3/t12-,13-,15-,16+,17-,21+/m1/s1
SMILES CC(C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)COc1c2occc2cc2ccc(=O)oc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaePrangos pabularia Ref.
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