input word = C00012629

Metabolite InformationStructural formula
Name 15-Deacetylcalonectrin
15-Decalonectrin
15-Desacetylcalonectrin
15-O-Deacetylcalonectrin
Formula C17H24O5
Mw 308.16237388
CAS RN 38818-66-5
C_ID C00012629 ,
InChIKey DFPPNUOWRKIOKO-DALIFSLHNA-N
InChICode InChI=1S/C17H24O5/c1-10-4-5-16(8-18)13(6-10)22-14-12(21-11(2)19)7-15(16,3)17(14)9-20-17/h6,12-14,18H,4-5,7-9H2,1-3H3/t12-,13-,14?,15+,16-,17+/m1/s1
SMILES CC(=O)O[C@@H]1CC2(C)C3(CO3)[C@@H]1O[C@@H]1C=C(C)CC[C@@]12CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiNectriaceaeCalonectria nivalis Ref.
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