input word = C00055423

Metabolite InformationStructural formula
Name Betulafolienetriol
Formula C30H52O3
Mw 460.39164553
CAS RN 6892-79-1
C_ID C00055423
InChIKey PYXFVCFISTUSOO-FVTNMGPZSA-N
InChICode InChI=1S/C30H52O3/c1-19(2)10-9-14-30(8,33)20-11-16-29(7)25(20)21(31)18-23-27(5)15-13-24(32)26(3,4)22(27)12-17-28(23,29)6/h10,20-25,31-33H,9,11-18H2,1-8H3/t20-,21+,22-,23+,24+,25-,27-,28+,29-,30-/m0/s1
SMILES CC(C)=CCC[C@](C)(O)[C@H]1CC[C@@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@@H](O)C(C)(C)[C@@H]3CC[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax ginseng Ref.
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OrganismPanax ginseng
ReferenceUvarova, N.I. et al., Chem. Nat. Compd. (Engl. Transl.), 1965, 1, 63-66 (Panaxosides)