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

Feedback

4-nitrophenyl phosphate

	Properties	Image
MNX_ID	MNXM3867
reference	chebi:61146
formula	C₆H₄NO₆P
global charge	-2
mol weight	217.073
InChIKey	XZKIHKMTEMTJQX-UHFFFAOYSA-L
InChI	InChI=1S/C6H6NO6P/c8-7(9)5-1-3-6(4-2-5)13-14(10,11)12/h1-4H,(H2,10,11,12)/p-2
SMILES	O=[N+]([O-])C1=CC=C(OP(=O)([O-])[O-])C=C1

MNX internals

InChI (mnx)	InChI=1/C6H6NO6P/c8-7(9)5-1-3-6(4-2-5)13-14(10,11)12/h1-4H,(H2,10,11,12)
SMILES (mnx)	[CH:1]1=[CH:3][C:6]([O:13][P:14]([OH:10])([OH:11])=[O:12])=[CH:4][CH:2]=[C:5]1[N+:7]([O-:8])=[O:9]

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
CHEBI:61146 chebi:61146 XZKIHKMTEMTJQX-UHFFFAOYSA-L	4-nitrophenyl phosphate 4-nitrophenyl phosphate dianion 4-nitrophenyl phosphate(2-) mono(4-nitrophenyl)phosphate dianion mono(4-nitrophenyl)phosphate(2-) mono(p-nitrophenyl)phosphate mono(p-nitrophenyl)phosphate dianion mono(p-nitrophenyl)phosphate(2-) p-nitrophenyl phosphate p-nitrophenyl phosphate dianion p-nitrophenyl phosphate(2-)
kegg.compound:C03360 keggC:C03360 XZKIHKMTEMTJQX-UHFFFAOYSA-N	4-Nitrophenyl phosphate
hmdb:HMDB0060272 XZKIHKMTEMTJQX-UHFFFAOYSA-N	4-Nitrophenyl phosphate 4-Nitrophenyl phosphoric acid 4-Nitrophenylphosphate Diammonium nitrophenylphosphate Dipotassium nitrophenylphosphate Disodium nitrophenylphosphate Magnesium nitrophenylphosphate Monosodium nitrophenylphosphate Nitrophenylphosphate Nitrophenylphosphoric acid Phosphate, mono(4-nitrophenyl) ester Phosphate, mono(p-nitrophenyl) ester Phosphoric acid, mono(4-nitrophenyl) ester Phosphoric acid, mono(p-nitrophenyl) ester Sodium nitrophenylphosphate p-Nitrophenol phosphate p-Nitrophenyl dihydrogen phosphate p-Nitrophenyl dihydrogen phosphoric acid p-Nitrophenyl phosphate p-Nitrophenyl phosphoric acid
seed.compound:cpd02135 seedM:cpd02135 XZKIHKMTEMTJQX-UHFFFAOYSA-L	4-Nitrophenyl phosphate 4-nitrophenyl phosphate NO2-phen-P Para-Nitrophenylphosphate nitrophenol-P nitrophenol-phosphate p-nitrophenyl phosphate pNPP para-nitrophenyl phosphate
sabiork.compound:1743 sabiorkM:1743 XZKIHKMTEMTJQX-UHFFFAOYSA-N	4-Nitrophenyl phosphate p-Nitrophenyl phosphate pNPP
bigg.metabolite:HC01104 biggM:HC01104 XZKIHKMTEMTJQX-UHFFFAOYSA-L	4-nitrophenyl phosphate(2-)
vmhM:HC01104 vmhmetabolite:HC01104 XZKIHKMTEMTJQX-UHFFFAOYSA-L	4-nitrophenyl phosphate(2-) (4-nitrophenoxy)phosphonic acid
CHEBI:17440 chebi:17440 XZKIHKMTEMTJQX-UHFFFAOYSA-N	4-nitrophenyl phosphate 4-NITROPHENYL PHOSPHATE 4-Nitrophenyl phosphate 4-nitrophenyl dihydrogen phosphate nitrophenylphosphate p-nitrophenyl dihydrogen phosphate p-nitrophenyl phosphate phosphoric acid, mono(4-nitrophenyl) ester phosphoric acid, mono(p-nitrophenyl) ester
metacyc.compound:CPD-194 metacycM:CPD-194 XZKIHKMTEMTJQX-UHFFFAOYSA-L	4-nitrophenyl phosphate NO2-phen-P nitrophenol-P nitrophenol-phosphate p-nitrophenyl phosphate pNPP para-nitrophenyl phosphate
envipath:...0c2c4c5aab4f envipathM:...0c2c4c5aab4f XZKIHKMTEMTJQX-UHFFFAOYSA-M	compound 0060887
hmdb:HMDB60272 chebi:12035 chebi:163877 chebi:1915 chebi:20458 chebi:40049 biggM:M_HC01104 keggC:M_C03360 seedM:M_cpd02135 vmhM:M_HC01104	secondary/obsolete/fantasy identifier