colnelenate
Chemical Formula:
C18H27O3
Molecular Weight:
291.409 Daltons
Monoisotopic Mass:
292.20384476510003 Daltons
SMILES:
CCC=CCC=CC=COC=CCCCCCCC([O-])=O
InChI:
1S/C18H28O3/c1-2-3-4-5-7-10-13-16-21-17-14-11-8-6-9-12-15-18(19)20/h3-4,7,10,13-14,16-17H,2,5-6,8-9,11-12,15H2,1H3,(H,19,20)/p-1/b4-3-,10-7-,16-13+,17-14+
InChIKey:
Synonyms
- colnelenic acid
Databases
MetaCyc:
CPD-8680
RefMet:
Colnelenic acid
HMDB:
HMDB30996
ChEBI:
60960
KEGG:
C16320
Seed:
cpd15036
MetaNetX:
MNXM5101