input word = C00044472

Metabolite InformationStructural formula
Name 6beta-Hydroxy-18-acetoxycassan-13,15-diene
(-)-6beta-Hydroxy-18-acetoxycassan-13,15-diene
Formula C22H34O3
Mw 346.25079495
CAS RN 578716-48-0
C_ID C00044472 ,
InChIKey SVXPDLNSXIXYEA-BUFUELCENA-N
InChICode InChI=1S/C22H34O3/c1-6-16-8-9-18-17(14(16)2)12-19(24)20-21(4,13-25-15(3)23)10-7-11-22(18,20)5/h6,17-20,24H,1,7-13H2,2-5H3/t17-,18-,19+,20-,21-,22+/m0/s1
SMILES C1C[C@]([C@H]2[C@](C1)([C@@H]1[C@@H](C[C@H]2O)C(=C(CC1)C=C)C)C)(COC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeMyrospermum frutescens Ref.
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