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

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(2E)-but-2-enal

	Properties	Image
MNX_ID	MNXM1364431
reference	chebi:41607
formula	C₄H₆O
global charge	0
mol weight	70.091
InChIKey	MLUCVPSAIODCQM-NSCUHMNNSA-N
InChI	InChI=1S/C4H6O/c1-2-3-4-5/h2-4H,1H3/b3-2+
SMILES	C/C=C/C=O

MNX internals

InChI (mnx)	InChI=1/C4H6O/c1-2-3-4-5/h2-4H,1H3/b3-2+
SMILES (mnx)	[CH3:1]/[CH:2]=[CH:3]/[CH:4]=[O:5]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:41607 chebi:41607 MLUCVPSAIODCQM-NSCUHMNNSA-N	(2E)-but-2-enal (2E)-BUT-2-ENAL (E)-crotonaldehyde 1-formylpropene 2-Butenal aldehyde crotonique beta-methylacrolein crotonal crotonaldehyde crotonic aldehyde crotylaldehyde methylpropenal propylene aldehyde trans-2-butenal trans-2-butenaldehyde trans-but-2-enal trans-crotonaldehyde
hmdb:HMDB0034233 MLUCVPSAIODCQM-NSCUHMNNSA-N	2-Butenal (2E)-2-Butenal (2E)-BUT-2-enal (2E)-but-2-enal (e)-2-Butenal (e)-But-2-en-1-al (e)-Crotonaldehyde 1-Formylpropene 2(e)-Butenal 2-Butenal, (e)-isomer 2-Butenaldehyde Aldehyde crotonique But-2-en-1-al Crotonal Crotonaldehyde Crotonic aldehyde Crotylaldehyde Methylpropenal Propylene aldehyde b-Methylacrolein beta-Methylacrolein beta-methylacrolein crotonaldehyde trans-2-Buten-1-al trans-2-Butenal trans-2-Butenaldehyde trans-But-2-enal trans-Crotonal trans-Crotonaldehyde
sabiork.compound:20832 sabiorkM:20832 MLUCVPSAIODCQM-NSCUHMNNSA-N	Crotonaldehyde
seed.compound:cpd20633 seedM:cpd20633 kegg.compound:C19377 keggC:C19377 MLUCVPSAIODCQM-NSCUHMNNSA-N	Crotonaldehyde 2-Butenal
metacyc.compound:CPD-23505 metacycM:CPD-23505 MLUCVPSAIODCQM-NSCUHMNNSA-N	crotonaldehyde (2E)-but-2-enal (E)-crotonaldehyde 1-formylpropene crotonal methylpropenal trans-2-butenal
hmdb:HMDB34233 keggC:M_C19377 seedM:M_cpd20633	secondary/obsolete/fantasy identifier