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Phenytoin arene-oxide

PropertiesImage
MNX_IDMNXM159652 Image of MNXM159652
referencechebi:174532
formulaC15H12N2O3
global charge0
mol weight268.272
InChIKeyWBRFFCOFWKCXFD-UHFFFAOYSA-N
InChIInChI=1S/C15H12N2O3/c18-13-15(17-14(19)16-13,9-4-2-1-3-5-9)10-6-7-11-12(8-10)20-11/h1-8,11-12H,(H2,16,17,18,19)
SMILESO=C1NC(=O)C(C2=CC3OC3C=C2)(c2ccccc2)N1
MNX internals
InChI (mnx)InChI=1/C15H12N2O3/c18-13-15(17-14(19)16-13,9-4-2-1-3-5-9)10-6-7-11-12(8-10)20-11/h1-8,11-12H,(H2,16,17,18,19)/t11?,12?,15? Image of MNXM159652
SMILES (mnx)[cH:1]1[cH:2][cH:4][c:9]([C:15]2([C:10]3=[CH:8][CH:12]4[CH:11]([CH:7]=[CH:6]3)[O:20]4)[C:13](=[O:18])[NH:16][C:14](=[O:19])[NH:17]2)[cH:5][cH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:174532
chebi:174532
WBRFFCOFWKCXFD-UHFFFAOYSA-N 		Phenytoin arene-oxide
5-(7-oxabicyclo[4.1.0]hepta-2,4-dien-3-yl)-5-phenylimidazolidine-2,4-dione

vmhM:phenareno
vmhM:phenareno
vmhmetabolite:phenareno
vmhmetabolite:phenareno
WBRFFCOFWKCXFD-UHFFFAOYSA-N 		Phenytoin arene-oxide
hmdb:HMDB0060864
WBRFFCOFWKCXFD-UHFFFAOYSA-N 		Phenytoin arene-oxide
5-{7-oxabicyclo[4.1.0]hepta-2,4-dien-3-yl}-5-phenylimidazolidine-2,4-dione

hmdb:HMDB60864
vmhM:M_phenareno 		secondary/obsolete/fantasy identifier