input word = C00012944

Metabolite InformationStructural formula
Name Virginin
[3S-(3alpha,3abeta,4abeta,8aalpha,9abeta)]-3a,4a,5,8a,9,9a-Hexahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2,6(3H,4H)-dione
Formula C15H18O3
Mw 246.12559444
CAS RN 36170-17-9
C_ID C00012944 ,
InChIKey PCTOUSAHXOXMBC-PYVRLFRTNA-N
InChICode InChI=1S/C15H18O3/c1-8-10-6-11-9(2)12(16)4-5-15(11,3)7-13(10)18-14(8)17/h4-5,8,10-11,13H,2,6-7H2,1,3H3/t8-,10+,11-,13+,15-/m0/s1
SMILES C=C1C(=O)C=C[C@]2(C)C[C@H]3OC(=O)[C@@H](C)[C@H]3C[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEncelia virginensis Ref.
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