MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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fumigermin

	Properties	Image
MNX_ID	MNXM1113175
reference	chebi:147341
formula	C₁₁H₁₄O₃
global charge	0
mol weight	194.23
InChIKey	FBHONFXHWOMMPP-AATRIKPKSA-N
InChI	InChI=1S/C11H14O3/c1-5-6(2)10-7(3)9(12)8(4)11(13)14-10/h5,12H,1-4H3/b6-5+
SMILES	C/C=C(\C)C1=C(C)C(O)=C(C)C(=O)O1

MNX internals

InChI (mnx)	InChI=1/C11H14O3/c1-5-6(2)10-7(3)9(12)8(4)11(13)14-10/h5,12H,1-4H3/b6-5+
SMILES (mnx)	[CH3:1]/[CH:5]=[C:6](\[CH3:2])[C:10]1=[C:7]([CH3:3])[C:9]([OH:12])=[C:8]([CH3:4])[C:11](=[O:13])[O:14]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	1

Similar chemical compounds in external resources
Identifier	Description
CHEBI:147341 chebi:147341 FBHONFXHWOMMPP-AATRIKPKSA-N	fumigermin 6-[(2E)-but-2-en-2-yl]-4-hydroxy-3,5-dimethyl-2H-pyran-2-one