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

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droxicam

	Properties	Image
MNX_ID	MNXM51625
reference	chebi:76133
formula	C₁₆H₁₁N₃O₅S
global charge	0
mol weight	357.347
InChIKey	OEHFRZLKGRKFAS-UHFFFAOYSA-N
InChI	InChI=1S/C16H11N3O5S/c1-18-13-14(10-6-2-3-7-11(10)25(18,22)23)24-16(21)19(15(13)20)12-8-4-5-9-17-12/h2-9H,1H3
SMILES	CN1C2=C(OC(=O)N(C3=CC=CC=N3)C2=O)C2=CC=CC=C2S1(=O)=O

MNX internals

InChI (mnx)	InChI=1/C16H11N3O5S/c1-18-13-14(10-6-2-3-7-11(10)25(18,22)23)24-16(21)19(15(13)20)12-8-4-5-9-17-12/h2-9H,1H3
SMILES (mnx)	[CH3:1][N:18]1[C:13]2=[C:14]([C:10]3=[CH:6][CH:2]=[CH:3][CH:7]=[C:11]3[S:25]1(=[O:22])=[O:23])[O:24][C:16](=[O:21])[N:19]([C:12]1=[CH:8][CH:4]=[CH:5][CH:9]=[N:17]1)[C:15]2=[O:20]

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD-25152 metacycM:CPD-25152 CHEBI:76133 chebi:76133 OEHFRZLKGRKFAS-UHFFFAOYSA-N	droxicam 5-methyl-3-(pyridin-2-yl)-2H,5H-[1,3]oxazino[5,6-c][1,2]benzothiazine-2,4(3H)-dione 6,6-dioxide droxicamum
kegg.drug:D07267 keggD:D07267 OEHFRZLKGRKFAS-UHFFFAOYSA-N	Droxicam (INN)
hmdb:HMDB0251624 OEHFRZLKGRKFAS-UHFFFAOYSA-N	Droxicam 5-Methyl-3-(2-pyridyl)-2H,5H-1,3-oxazino(5,6-c)(1,2)benzothiazine-2,4(3H)dione-6,6-dioxide 8-methyl-5-(pyridin-2-yl)-3-oxa-9lambda⁶-thia-5,8-diazatricyclo[8.4.0.0²,⁷]tetradeca-1(14),2(7),10,12-tetraene-4,6,9,9-tetrone Droxicamum droxicam
keggD:M_D07267	secondary/obsolete/fantasy identifier