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(3-nitro-4-oxidophenyl)acetate

PropertiesImage
MNX_IDMNXM31169 Image of MNXM31169
referencechebi:71332
formulaC8H5NO5
global charge-2
mol weight195.13
InChIKeyQBHBHOSRLDPIHG-UHFFFAOYSA-L
InChIInChI=1S/C8H7NO5/c10-7-2-1-5(4-8(11)12)3-6(7)9(13)14/h1-3,10H,4H2,(H,11,12)/p-2
SMILESO=C([O-])CC1=CC=C([O-])C([N+](=O)[O-])=C1
MNX internals
InChI (mnx)InChI=1/C8H7NO5/c10-7-2-1-5(4-8(11)12)3-6(7)9(13)14/h1-3,10H,4H2,(H,11,12) Image of MNXM31169
SMILES (mnx)[CH:1]1=[CH:2][C:7]([OH:10])=[C:6]([N+:9]([O-:13])=[O:14])[CH:3]=[C:5]1[CH2:4][C:8](=[O:11])[OH:12]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:71332
chebi:71332
QBHBHOSRLDPIHG-UHFFFAOYSA-L 		(3-nitro-4-oxidophenyl)acetate
4-hydroxy-3-nitrophenylacetate

CHEBI:53794
chebi:53794
QBHBHOSRLDPIHG-UHFFFAOYSA-M 		(4-hydroxy-3-nitrophenyl)acetate
2-(4-hydroxy-3-nitrophenyl)acetate
4-hydroxy-3-nitrophenylacetate

CHEBI:546274
chebi:546274
QBHBHOSRLDPIHG-UHFFFAOYSA-N 		(4-hydroxy-3-nitrophenyl)acetic acid
2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID
2-(4-hydroxy-3-nitrophenyl)acetic acid
4-hydroxy-3-nitrophenylacetic acid
NO2HPA

bigg.metabolite:4h3npac
biggM:4h3npac 		4 Hydroxy 3 Nitro Phenylacetic acid

envipath:...b7541472d549
envipathM:...b7541472d549
QBHBHOSRLDPIHG-UHFFFAOYSA-M 		4-Hydroxy-3-nitrophenylacetate

bigg.metabolite:CE1957
biggM:CE1957
QBHBHOSRLDPIHG-UHFFFAOYSA-L 		4-hydroxy-3-nitrophenylacetate
hmdb:HMDB0062403
QBHBHOSRLDPIHG-UHFFFAOYSA-N 		4-hydroxy-3-nitrophenylacetate
(4-Hydroxy-3-nitrophenyl)acetyl
(4-hydroxy-3-nitrophenyl)acetic acid
2-(4-HYDROXY-3-nitrophenyl)acetIC ACID
2-(4-HYDROXY-3-nitrophenyl)acetate
2-(4-hydroxy-3-nitrophenyl)acetic acid
3-Nitro-4-hydroxyphenylacetic acid
4-Hydroxy-3-nitrophenyl acetyl
4-Hydroxy-3-nitrophenylacetate
4-Hydroxy-3-nitrophenylacetic acid
4-Hydroxy-3-nitrophenylacetyl
4-Hydroxy-5-nitrophenyl acetic acid
4-OHNOPHAX
Hapten NP
NO2hpa
NP-Hapten

vmhM:CE1957
vmhmetabolite:CE1957
QBHBHOSRLDPIHG-UHFFFAOYSA-L 		4-hydroxy-3-nitrophenylacetate
4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol

hmdb:HMDB62403
chebi:44475
biggM:M_4h3npac
biggM:M_CE1957
vmhM:M_CE1957 		secondary/obsolete/fantasy identifier