input word = C00012598

Metabolite InformationStructural formula
Name Crotocol
Formula C15H20O4
Mw 264.13615913
CAS RN 21445-21-6
C_ID C00012598 ,
InChIKey VVHSWJHVTAZPBN-HVFFNNQLNA-N
InChICode InChI=1S/C15H20O4/c1-7-4-9-13(2,12-11(7)19-12)14(3)8(16)5-10(18-9)15(14)6-17-15/h4,8-12,16H,5-6H2,1-3H3/t8-,9-,10-,11+,12+,13+,14-,15+/m1/s1
SMILES CC1=C[C@H]2O[C@@H]3C[C@@H](O)C(C)([C@@]2(C)[C@H]2O[C@@H]12)[C@]31CO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Cephalosporum crotigenum Ref.
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