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

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4-pyridoxolactone

	Properties	Image
MNX_ID	MNXM1896
reference	chebi:16871
formula	C₈H₇NO₃
global charge	0
mol weight	165.148
InChIKey	HHPDVQLBYQFYFA-UHFFFAOYSA-N
InChI	InChI=1S/C8H7NO3/c1-4-7(10)6-5(2-9-4)3-12-8(6)11/h2,10H,3H2,1H3
SMILES	CC1=C(O)C2=C(C=N1)COC2=O

MNX internals

InChI (mnx)	InChI=1/C8H7NO3/c1-4-7(10)6-5(2-9-4)3-12-8(6)11/h2,10H,3H2,1H3
SMILES (mnx)	[CH3:1][C:4]1=[N:9][CH:2]=[C:5]2[CH2:3][O:12][C:8](=[O:11])[C:6]2=[C:7]1[OH:10]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16871 chebi:16871 HHPDVQLBYQFYFA-UHFFFAOYSA-N	4-pyridoxolactone 4-Pyridoxic acid lactone 4-Pyridoxolactone 4-pyridoxic acid lactone 7-hydroxy-6-methylfuro[3,4-c]pyridin-1(3H)-one
envipath:...8604717c958f envipathM:...8604717c958f sabiork.compound:5343 sabiorkM:5343 HHPDVQLBYQFYFA-UHFFFAOYSA-N	4-Pyridoxolactone
hmdb:HMDB0003454 HHPDVQLBYQFYFA-UHFFFAOYSA-N	4-Pyridoxolactone 4-Pyridoxate lactone 4-Pyridoxic acid lactone 4-pyridoxolactone 7-hydroxy-6-methyl-1H,3H-furo[3,4-c]pyridin-1-one beta-Pyracin
kegg.compound:C00971 keggC:C00971 HHPDVQLBYQFYFA-UHFFFAOYSA-N	4-Pyridoxolactone 4-Pyridoxic acid lactone
seed.compound:cpd00715 seedM:cpd00715 HHPDVQLBYQFYFA-UHFFFAOYSA-N	4-Pyridoxolactone 4-Pyridoxic acid lactone 4-pyridoxolactone
vmhM:4pyrdxlctn vmhmetabolite:4pyrdxlctn HHPDVQLBYQFYFA-UHFFFAOYSA-N	4-Pyridoxolactone 7-hydroxy-6-methyl-1H,3H-furo[3,4-c]pyridin-1-one
metacyc.compound:CPD-375 metacycM:CPD-375 HHPDVQLBYQFYFA-UHFFFAOYSA-N	4-pyridoxolactone
hmdb:HMDB03454 chebi:12044 chebi:1929 chebi:20475 keggC:M_C00971 seedM:M_cpd00715 vmhM:M_4pyrdxlctn	secondary/obsolete/fantasy identifier