input word = C00042459

Metabolite InformationStructural formula
Name Demethylincisterol A1
Formula C20H30O3
Mw 318.21949482
CAS RN 849752-85-8
C_ID C00042459 ,
InChIKey AQPJSQVQFSPDJH-KOYWIPPSNA-N
InChICode InChI=1S/C20H30O3/c1-13(2)6-5-7-14(3)15-8-9-16-17-12-18(21)23-20(17,22)11-10-19(15,16)4/h5,7,12-16,22H,6,8-11H2,1-4H3/b7-5+/t14-,15+,16-,19+,20-/m0/s1
SMILES CC(C)C/C=C/[C@@H](C)[C@H]1CC[C@H]2C3=CC(=O)O[C@@]3(O)CC[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaSuberitidaeHomaxinella sp. Ref.
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