isotrichodermin (CHEBI:157608)

CHEBI:157608 - isotrichodermin

Formula	C17H24O4
Net Charge	0
Average Mass	292.375
Monoisotopic Mass	292.16746
SMILES	[H][C@@]12C=C(C)CC[C@]1(C)[C@@]1(C)C[C@@H](OC(C)=O)[C@@]([H])(O2)[C@@]12CO2
InChI	InChI=1S/C17H24O4/c1-10-5-6-15(3)13(7-10)21-14-12(20-11(2)18)8-16(15,4)17(14)9-19-17/h7,12-14H,5-6,8-9H2,1-4H3/t12-,13-,14-,15+,16-,17+/m1/s1
InChIKey	OZXJPPYWZVBMGW-IKIFYQGPSA-N

ChEBI Ontology

Outgoing Relation(s)
	isotrichodermin (CHEBI:157608) is a sesquiterpenoid (CHEBI:26658)

UniProt Name	Source
isotrichodermin	UniProt

Manual Xrefs	Databases
CPD-18409	MetaCyc

Citations