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

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picric acid

	Properties	Image
MNX_ID	MNXM129686
reference	chebi:46149
formula	C₆H₃N₃O₇
global charge	0
mol weight	229.104
InChIKey	OXNIZHLAWKMVMX-UHFFFAOYSA-N
InChI	InChI=1S/C6H3N3O7/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-2,10H
SMILES	O=[N+]([O-])C1=CC([N+](=O)[O-])=C(O)C([N+](=O)[O-])=C1

MNX internals

InChI (mnx)	InChI=1/C6H3N3O7/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-2,10H
SMILES (mnx)	[CH:1]1=[C:3]([N+:7]([O-:11])=[O:12])[CH:2]=[C:5]([N+:9]([O-:15])=[O:16])[C:6]([OH:10])=[C:4]1[N+:8]([O-:13])=[O:14]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:46149 chebi:46149 OXNIZHLAWKMVMX-UHFFFAOYSA-N	picric acid 2,4,6-trinitrophenol 2-hydroxy-1,3,5-trinitrobenzene C.I. 10305 CI 10305 PICRIC ACID Pikrinsaeure TNP acide picrique
seed.compound:cpd31449 seedM:cpd31449 OXNIZHLAWKMVMX-UHFFFAOYSA-M	2,4,6-TNP 2,4,6-trinitrophenol 2-hydroxy-1,3,5-trinitrobenzene picrate picric acid
envipath:...e59548d0b709 envipathM:...e59548d0b709 OXNIZHLAWKMVMX-UHFFFAOYSA-M	2,4,6-Trinitrophenol
metacyc.compound:CPD-17566 metacycM:CPD-17566 OXNIZHLAWKMVMX-UHFFFAOYSA-M	2,4,6-trinitrophenol 2,4,6-TNP 2-hydroxy-1,3,5-trinitrobenzene picrate picric acid
hmdb:HMDB0256536 OXNIZHLAWKMVMX-UHFFFAOYSA-N	Picric acid 2,4,6-Trinitrophenol 2,4,6-trinitrophenol 2-Hydroxy-1,3,5-trinitrobenzene Acide picrique C.I. 10305 CI 10305 Picrate Picric acid, ammonium salt Picric acid, lead (2+) salt Picric acid, potassium salt Picric acid, sodium salt Pikrinsaeure TNP Trinitrophenol picric acid
CHEBI:86297 chebi:86297 OXNIZHLAWKMVMX-UHFFFAOYSA-M	picrate anion 2,4,6-trinitrophenolate 2,4,6-trinitrophenolate ion 2,4,6-trinitrophenoxide 2,4,6-trinitrophenoxide ion picrate picrate ion
chebi:32972 chebi:46148 seedM:M_cpd31449	secondary/obsolete/fantasy identifier