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

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propynoate

	Properties	Image
MNX_ID	MNXM2422
reference	chebi:15364
formula	C₃HO₂
global charge	-1
mol weight	69.039
InChIKey	UORVCLMRJXCDCP-UHFFFAOYSA-M
InChI	InChI=1S/C3H2O2/c1-2-3(4)5/h1H,(H,4,5)/p-1
SMILES	C#CC(=O)[O-]

MNX internals

InChI (mnx)	InChI=1/C3H2O2/c1-2-3(4)5/h1H,(H,4,5)
SMILES (mnx)	[CH:1]#[C:2][C:3](=[O:4])[OH:5]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	1

Similar chemical compounds in external resources
Identifier	Description
CHEBI:15364 chebi:15364 UORVCLMRJXCDCP-UHFFFAOYSA-M	propynoate Acetylenemonocarboxylate Propiolat acetylenecarboxylate prop-2-ynoate propiolate
vmhM:prpnt vmhmetabolite:prpnt UORVCLMRJXCDCP-UHFFFAOYSA-M	Propynoate
sabiork.compound:2162 sabiorkM:2162 kegg.compound:C00804 keggC:C00804 UORVCLMRJXCDCP-UHFFFAOYSA-N	Propynoate Acetylenecarboxylic acid Acetylenemonocarboxylate Propiolic acid
seed.compound:cpd00598 seedM:cpd00598 UORVCLMRJXCDCP-UHFFFAOYSA-M	Propynoate Acetylenecarboxylic acid Acetylenemonocarboxylate Propiolic acid acetylene monocarboxylic acid propynoate
hmdb:HMDB0006804 UORVCLMRJXCDCP-UHFFFAOYSA-N	Propynoic acid 2-Propynoate 2-Propynoic acid Acetylenate Acetylenecarboxylate Acetylenecarboxylic acid Acetylenemonocarboxylate Acetylenemonocarboxylic acid Acetylenic acid Carboxyacetylene HC#ccooh Propargylate Propargylic acid Propinate Propinic acid Propinsaeure Propiolate Propiolic acid Propiolic acid, monosodium salt Propiolsaeure Propynoate prop-2-ynoic acid propiolic acid
envipath:...f5f5ce948b35 envipathM:...f5f5ce948b35 UORVCLMRJXCDCP-UHFFFAOYSA-M	compound 0283473
metacyc.compound:CPD-661 metacycM:CPD-661 UORVCLMRJXCDCP-UHFFFAOYSA-M	propynoate Acetylenecarboxylic acid Acetylenemonocarboxylate Propiolic acid acetylene monocarboxylic acid
CHEBI:33199 chebi:33199 UORVCLMRJXCDCP-UHFFFAOYSA-N	propynoic acid 2-propynoic acid Acetylenecarboxylic acid HC#CCOOH Propinsaeure Propiolic acid Propiolsaeure acetylenic acid carboxyacetylene prop-2-ynoic acid propargylic acid propinic acid
hmdb:HMDB06804 chebi:14908 chebi:26303 chebi:26312 chebi:8503 keggC:M_C00804 seedM:M_cpd00598 vmhM:M_prpnt	secondary/obsolete/fantasy identifier