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

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3-hydroxy-4-methylanthranilate

	Properties	Image
MNX_ID	MNXM4334
reference	chebi:36558
formula	C₈H₈NO₃
global charge	-1
mol weight	166.156
InChIKey	OYZONAXDAWHDMN-UHFFFAOYSA-M
InChI	InChI=1S/C8H9NO3/c1-4-2-3-5(8(11)12)6(9)7(4)10/h2-3,10H,9H2,1H3,(H,11,12)/p-1
SMILES	CC1=C(O)C(N)=C(C(=O)[O-])C=C1

MNX internals

InChI (mnx)	InChI=1/C8H9NO3/c1-4-2-3-5(8(11)12)6(9)7(4)10/h2-3,10H,9H2,1H3,(H,11,12)
SMILES (mnx)	[CH3:1][C:4]1=[C:7]([OH:10])[C:6]([NH2:9])=[C:5]([C:8](=[O:11])[OH:12])[CH:3]=[CH:2]1

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
CHEBI:36558 chebi:36558 OYZONAXDAWHDMN-UHFFFAOYSA-M	3-hydroxy-4-methylanthranilate 2-amino-3-hydroxy-4-methylbenzoate
kegg.compound:C03986 keggC:C03986 vmhM:hmanthnt vmhmetabolite:hmanthnt OYZONAXDAWHDMN-UHFFFAOYSA-N	3-Hydroxy-4-methylanthranilate
seed.compound:cpd02472 seedM:cpd02472 OYZONAXDAWHDMN-UHFFFAOYSA-M	3-Hydroxy-4-methylanthranilate 3-hydroxy-4-methylanthranilate 3-hydroxy-4-methylanthranilic acid
metacyc.compound:CPD-403 metacycM:CPD-403 OYZONAXDAWHDMN-UHFFFAOYSA-M	3-hydroxy-4-methylanthranilate 3-hydroxy-4-methylanthranilic acid
CHEBI:16116 chebi:16116 OYZONAXDAWHDMN-UHFFFAOYSA-N	3-hydroxy-4-methylanthranilic acid 2-amino-3-hydroxy-4-methylbenzoic acid 3,4-Cresotic acid, 2-amino- 4-Methyl-3-hydroxyanthranilic acid
chebi:11816 chebi:1527 chebi:20046 keggC:M_C03986 seedM:M_cpd02472 vmhM:M_hmanthnt	secondary/obsolete/fantasy identifier