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

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mephenytoin

	Properties	Image
MNX_ID	MNXM61418
reference	chebi:6757
formula	C₁₂H₁₄N₂O₂
global charge	0
mol weight	218.256
InChIKey	GMHKMTDVRCWUDX-UHFFFAOYSA-N
InChI	InChI=1S/C12H14N2O2/c1-3-12(9-7-5-4-6-8-9)10(15)14(2)11(16)13-12/h4-8H,3H2,1-2H3,(H,13,16)
SMILES	CCC1(C2=CC=CC=C2)NC(=O)N(C)C1=O

MNX internals

InChI (mnx)	InChI=1/C12H14N2O2/c1-3-12(9-7-5-4-6-8-9)10(15)14(2)11(16)13-12/h4-8H,3H2,1-2H3,(H,13,16)/t12?
SMILES (mnx)	[CH3:1][CH2:3][C:12]1([C:9]2=[CH:7][CH:5]=[CH:4][CH:6]=[CH:8]2)[C:10](=[O:15])[N:14]([CH3:2])[C:11]([OH:16])=[N:13]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:6757 chebi:6757 GMHKMTDVRCWUDX-UHFFFAOYSA-N	mephenytoin 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione DL-Mephenytoin mefenitoina mephenytoine mephenytoinum methylphenetoin phenylethylmethylhydantoin
sabiork.compound:9251 sabiorkM:9251 GMHKMTDVRCWUDX-UHFFFAOYSA-N	Mephenytoin
kegg.drug:D00375 keggD:D00375 GMHKMTDVRCWUDX-UHFFFAOYSA-N	Mephenytoin (USP/INN) Mesantoin (TN)
hmdb:HMDB0014673 GMHKMTDVRCWUDX-UHFFFAOYSA-N	Mephenytoin 5 Ethyl 3 methyl 5 phenylhydantoin 5-Ethyl-3-methyl-5-phenylhydantoin 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione DL-Mephenytoin Mefenetoin Mefenitoina Mephentoin Mephenytoine Mephenytoinum Mesantoin Methoin Methyl hydantoin Methyl phenetoin Methylphenetoin Phenantoin Phenetoin, methyl Phenylethylmethylhydantoin mephenytoin
hmdb:HMDB14673 chebi:91914 keggD:M_D00375	secondary/obsolete/fantasy identifier