input word = C00031286

Metabolite InformationStructural formula
Name Sandaracopimarinol acetate
Formula C22H34O2
Mw 330.25588033
CAS RN 58383-59-8
C_ID C00031286 ,
InChIKey YAEKQWMHIISSGS-PFKXUYCMNA-N
InChICode InChI=1S/C22H34O2/c1-6-20(3)13-10-18-17(14-20)8-9-19-21(4,15-24-16(2)23)11-7-12-22(18,19)5/h6,14,18-19H,1,7-13,15H2,2-5H3/t18-,19-,20-,21-,22+/m0/s1
SMILES C1C[C@]([C@H]2[C@](C1)([C@@H]1C(=C[C@](CC1)(C=C)C)CC2)C)(COC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxodiaceaeCryptomeria japonica Ref.
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