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

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protoanemonin

	Properties	Image
MNX_ID	MNXM6408
reference	chebi:28906
formula	C₅H₄O₂
global charge	0
mol weight	96.085
InChIKey	RNYZJZKPGHQTJR-UHFFFAOYSA-N
InChI	InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2
SMILES	C=C1C=CC(=O)O1

MNX internals

InChI (mnx)	InChI=1/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2
SMILES (mnx)	[CH2:1]=[C:4]1[CH:2]=[CH:3][C:5](=[O:6])[O:7]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:28906 chebi:28906 RNYZJZKPGHQTJR-UHFFFAOYSA-N	protoanemonin 4-Methylenebut-2-en-4-olide 5-methylene-2(5H)-furanone 5-methylenefuran-2(5H)-one Protoanemonin cis-4-Methylenebut-2-en-4-olide
envipath:...e200093c6286 envipathM:...e200093c6286 RNYZJZKPGHQTJR-UHFFFAOYSA-N	4-Methylenebut-2-en-4-olide
hmdb:HMDB0060503 RNYZJZKPGHQTJR-UHFFFAOYSA-N	Protoanemonin 4-Methylenebut-2-en-4-olide 5-Methylene-2(5H)-furanone 5-Methylene-2-furanone 5-methylidene-2,5-dihydrofuran-2-one cis-4-Methylenebut-2-en-4-olide protoanemonin
sabiork.compound:9207 sabiorkM:9207 kegg.compound:C07090 keggC:C07090 RNYZJZKPGHQTJR-UHFFFAOYSA-N	Protoanemonin 4-Methylenebut-2-en-4-olide cis-4-Methylenebut-2-en-4-olide
seed.compound:cpd04365 seedM:cpd04365 RNYZJZKPGHQTJR-UHFFFAOYSA-N	Protoanemonin 4-Methylenebut-2-en-4-olide cis-4-Methylenebut-2-en-4-olide protoanemonin
metacyc.compound:CPD-10640 metacycM:CPD-10640 RNYZJZKPGHQTJR-UHFFFAOYSA-N	protoanemonin
hmdb:HMDB60503 chebi:20447 chebi:8585 keggC:M_C07090 seedM:M_cpd04365	secondary/obsolete/fantasy identifier