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

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(2E)-2-butenoate

	Properties	Image
MNX_ID	MNXM1107967
reference	chebi:35899
formula	C₄H₅O₂
global charge	-1
mol weight	85.082
InChIKey	LDHQCZJRKDOVOX-NSCUHMNNSA-M
InChI	InChI=1S/C4H6O2/c1-2-3-4(5)6/h2-3H,1H3,(H,5,6)/p-1/b3-2+
SMILES	C/C=C/C(=O)[O-]

MNX internals

InChI (mnx)	InChI=1/C4H6O2/c1-2-3-4(5)6/h2-3H,1H3,(H,5,6)/b3-2+
SMILES (mnx)	[CH3:1]/[CH:2]=[CH:3]/[C:4](=[O:5])[OH:6]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	1

Similar chemical compounds in external resources
Identifier	Description
CHEBI:35899 chebi:35899 LDHQCZJRKDOVOX-NSCUHMNNSA-M	(2E)-2-butenoate (2E)-but-2-enoate (E)-2-butenoate (E)-crotonate 2-butenoate 3-methylacrylate alpha-butenoate alpha-crotonate beta-methacrylate beta-methylacrylate crotonate trans-2-butenoate trans-crotonate
seed.compound:cpd01223 seedM:cpd01223 LDHQCZJRKDOVOX-NSCUHMNNSA-M	2-Butenoate (2E)-but-2-enoate (E)-2-butenoate 2-Butenoic acid 2-butenoate 2-butenoic acid 3-Methylacrylic acid Crotonic acid b-methylacrylic acid beta-methylacrylic acid crotonate crotonic acid trans-2-butenoic acid trans-but-2-enoate
kegg.compound:C01771 keggC:C01771 LDHQCZJRKDOVOX-NSCUHMNNSA-N	2-Butenoate (E)-But-2-enoic acid 2-Butenoic acid 3-Methylacrylic acid Crotonic acid
hmdb:HMDB0010720 LDHQCZJRKDOVOX-NSCUHMNNSA-N	But-2-enoic acid (2E)-2-Butenoate (2E)-2-Butenoic acid (2E)-But-2-enoate (2E)-But-2-enoic acid (2E)-but-2-enoic acid (e)-2-Butenoate (e)-2-Butenoic acid (e)-But-2-enoate (e)-But-2-enoic acid (e)-Crotonate (e)-Crotonic acid 2-Butenoate 2-Butenoic acid 3-Methyl-acrylic acid 3-Methylacrylate 3-Methylacrylic acid BEO But-2-enoate Butenoate Butenoic acid Crotonate Crotonic acid Kyselina krotonova Solid crotonic acid a-Butenoate a-Butenoic acid a-Crotonate a-Crotonic acid alpha-Butenoate alpha-Butenoic acid alpha-Crotonate alpha-Crotonic acid alpha-butenoate alpha-butenoic acid alpha-crotonate alpha-crotonic acid b-Methacrylate b-Methacrylic acid b-Methylacrylate b-Methylacrylic acid beta-Methacrylate beta-Methacrylic acid beta-Methylacrylate beta-Methylacrylic acid beta-methacrylate beta-methacrylic acid beta-methylacrylate beta-methylacrylic acid butenoic acid trans-2-Butenoate trans-2-Butenoic acid trans-Crotonate trans-Crotonic acid
lipidmaps:LMFA01030195 lipidmapsM:LMFA01030195 LDHQCZJRKDOVOX-NSCUHMNNSA-N	Crotonic acid 2E-butenoic acid C4:1n-2 FA 4:1 trans-2-butenoic acid
envipath:...fce7624b3f77 envipathM:...fce7624b3f77 LDHQCZJRKDOVOX-NSCUHMNNSA-M	compound 0046381
metacyc.compound:CROTONATE metacycM:CROTONATE LDHQCZJRKDOVOX-NSCUHMNNSA-M	crotonate (2E)-but-2-enoate (E)-2-butenoate 2-butenoate 2-butenoic acid b-methylacrylic acid beta-methylacrylic acid crotonic acid trans-2-butenoic acid trans-but-2-enoate
CHEBI:41131 chebi:41131 LDHQCZJRKDOVOX-NSCUHMNNSA-N	crotonic acid (2E)-2-butenoic acid (2E)-but-2-enoic acid (E)-2-Butenoic acid (E)-Crotonic acid (E)-but-2-enoic acid 2-Butenoic acid 2-butenoic acid 3-methylacrylic acid BEO Crotonic acid alpha-butenoic acid alpha-crotonic acid beta-methacrylic acid beta-methylacrylic acid trans-2-Butenoic acid trans-Crotonic Acid
hmdb:HMDB10720 chebi:36250 chebi:41125 keggC:M_C01771 seedM:M_cpd01223	secondary/obsolete/fantasy identifier