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3',4'-Dihydrodiol

Properties

Image

Occurences in reactions

MNX_ID

MNXM117139

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

formula

C₁₅H₁₄N₂O₄

charge

mass

286.09536

reference

InChIKey

FEEKFEKCXIDMIS-KOHJWAIASA-N

InChI

InChI=1S/C15H14N2O4/c18-11-7-6-10(8-12(11)19)15(9-4-2-1-3-5-9)13(20)16-14(21)17-15/h1-8,11-12,18-19H,(H2,16,17,20,21)/t11?,12?,15-/m1/s1

SMILES

O=C1NC(=O)[C@](C2=CC(O)C(O)C=C2)(c2ccccc2)N1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0013895 CHEBI:174720 chebi:174720	3',4'-Dihydrodiol (5R)-5-(3,4-dihydroxycyclohexa-1,5-dien-1-yl)-5-phenylimidazolidine-2,4-dione
CHEBI:166540 chebi:166540	5-(3,4-Dihydroxy-1,5-cyclohexadien-1-yl)-5-phenylhydantoin 5-(3,4-dihydroxycyclohexa-1,5-dien-1-yl)-5-phenylimidazolidine-2,4-dione
hmdb:HMDB0060866	Phenytoin dihydrodiol 5-(3,4-Dihydroxy-1,5-cyclohexadien-1-yl)-5-phenylhydantoin 5-(3,4-Dihydroxy-1,5-cyclohexadien-1-yl)-5-phenylhydantoin, (3R-(1(r),3alpha,4beta))-isomer 5-(3,4-Dihydroxy-1,5-cyclohexadien-1-yl)-5-phenylhydantoin, (3R-(1(s),3alpha,4beta))-isomer 5-(3,4-dihydroxycyclohexa-1,5-dien-1-yl)-5-phenylimidazolidine-2,4-dione 5-DCYPH
hmdb:HMDB13895 hmdb:HMDB60866	secondary/obsolete/fantasy identifier