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

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2-carbamoylbenzoic acid

	Properties	Image
MNX_ID	MNXM34923
reference	chebi:50736
formula	C₈H₇NO₃
global charge	0
mol weight	165.148
InChIKey	CYMRPDYINXWJFU-UHFFFAOYSA-N
InChI	InChI=1S/C8H7NO3/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H2,9,10)(H,11,12)
SMILES	NC(=O)C1=CC=CC=C1C(=O)O

MNX internals

InChI (mnx)	InChI=1/C8H7NO3/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H2,9,10)(H,11,12)
SMILES (mnx)	[CH:1]1=[CH:2][CH:4]=[C:6]([C:8](=[O:11])[OH:12])[C:5]([C:7](=[NH:9])[OH:10])=[CH:3]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:50736 chebi:50736 CYMRPDYINXWJFU-UHFFFAOYSA-N	2-carbamoylbenzoic acid 2-(aminocarbonyl)benzoic acid Phthalamic acid Phthalamide acid Phthalamidic acid Phthalic acid monoamide Phthalic monoamide o-Carbamoylbenzoic acid
envipath:...32922f1fa367 envipathM:...32922f1fa367 CYMRPDYINXWJFU-UHFFFAOYSA-N	Phthalamic acid
hmdb:HMDB0256499 CYMRPDYINXWJFU-UHFFFAOYSA-N	Phthalamic acid 2-(Aminocarbonyl)benzoate 2-(Aminocarbonyl)benzoic acid 2-(C-hydroxycarbonimidoyl)benzoic acid 2-Carbamoylbenzoate O-Carbamoylbenzoate O-Carbamoylbenzoic acid Phthalamate Phthalamidate Phthalamide acid Phthalamidic acid Phthalate monoamide Phthalic acid monoamide Phthalic monoamide
sabiork.compound:28693 sabiorkM:28693 CYMRPDYINXWJFU-UHFFFAOYSA-N	Phthalamic acid 2-Carbamoylbenzoic acid Phthalamide acid Phthalic acid monoamide
envipath:...ce598f1591e7 envipathM:...ce598f1591e7 CYMRPDYINXWJFU-UHFFFAOYSA-N	Phthalamic acid PaA (Phtalamic acid)