input word = C00012638

Metabolite InformationStructural formula
Name 15-Deacetylneosolaniol
Toxin NT 2
Formula C17H24O7
Mw 340.15220312
CAS RN 76348-84-0
C_ID C00012638 ,
InChIKey CSYVMZMEBKUDRQ-PFCWJRPDNA-N
InChICode InChI=1S/C17H24O7/c1-8-4-11-16(6-18,5-10(8)20)15(3)13(23-9(2)19)12(21)14(24-11)17(15)7-22-17/h4,10-14,18,20-21H,5-7H2,1-3H3/t10-,11+,12+,13+,14+,15+,16+,17+/m0/s1
SMILES CC(=O)O[C@@H]1[C@@H](O)[C@H]2O[C@@H]3C=C(C)[C@@H](O)C[C@]3(CO)C1(C)C21CO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiNectriaceaeFusarium sporotrichioides Ref.
FungiNectriaceaeFusarium tricinctum Ref.
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