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

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butanoyl phosphate

	Properties	Image
MNX_ID	MNXM2105
reference	chebi:58079
formula	C₄H₇O₅P
global charge	-2
mol weight	166.069
InChIKey	JSHMCUNOMIZJDJ-UHFFFAOYSA-L
InChI	InChI=1S/C4H9O5P/c1-2-3-4(5)9-10(6,7)8/h2-3H2,1H3,(H2,6,7,8)/p-2
SMILES	CCCC(=O)OP(=O)([O-])[O-]

MNX internals

InChI (mnx)	InChI=1/C4H9O5P/c1-2-3-4(5)9-10(6,7)8/h2-3H2,1H3,(H2,6,7,8)
SMILES (mnx)	[CH3:1][CH2:2][CH2:3][C:4](=[O:5])[O:9][P:10]([OH:6])([OH:7])=[O:8]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	4

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58079 chebi:58079 JSHMCUNOMIZJDJ-UHFFFAOYSA-L	butanoyl phosphate (butanoyloxy)phosphonate butanoyl phosphate dianion butanoyl phosphate(2-)
bigg.metabolite:butpi biggM:butpi vmhM:butpi vmhmetabolite:butpi JSHMCUNOMIZJDJ-UHFFFAOYSA-L	Butanoyl phosphate
sabiork.compound:1720 sabiorkM:1720 JSHMCUNOMIZJDJ-UHFFFAOYSA-N	Butanoyl phosphate Butanoylphosphate
kegg.compound:C02527 keggC:C02527 JSHMCUNOMIZJDJ-UHFFFAOYSA-N	Butanoylphosphate Butanoyl phosphate
seed.compound:cpd01662 seedM:cpd01662 JSHMCUNOMIZJDJ-UHFFFAOYSA-L	Butanoylphosphate Butanoyl phosphate butanoyl phosphate butpi butyryl phosphate butyryl-P phosphobutyrate
CHEBI:17260 chebi:17260 JSHMCUNOMIZJDJ-UHFFFAOYSA-N	butanoyl dihydrogen phosphate Butanoyl phosphate Butanoylphosphate
metacyc.compound:BUTYRYL-P metacycM:BUTYRYL-P JSHMCUNOMIZJDJ-UHFFFAOYSA-L	butanoyl phosphate butyryl phosphate butyryl-P phosphobutyrate
chebi:13925 chebi:13927 chebi:22952 chebi:3236 biggM:M_butpi keggC:M_C02527 seedM:M_cpd01662 vmhM:M_butpi	secondary/obsolete/fantasy identifier