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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H10N2O.C4H4O4
Molecular Weight 278.2607
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of AMINOREX FUMARATE, (S)-

SMILES

OC(=O)\C=C\C(O)=O.NC1=NC[C@@H](O1)C2=CC=CC=C2

InChI

InChIKey=ZVAWZQUDKKABKR-XQGNFNNSSA-N
InChI=1S/C9H10N2O.C4H4O4/c10-9-11-6-8(12-9)7-4-2-1-3-5-7;5-3(6)1-2-4(7)8/h1-5,8H,6H2,(H2,10,11);1-2H,(H,5,6)(H,7,8)/b;2-1+/t8-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C4H4O4
Molecular Weight 116.0722
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula C9H10N2O
Molecular Weight 162.1885
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:03:24 GMT 2023
Edited
by admin
on Sat Dec 16 09:03:24 GMT 2023
Record UNII
02K56MV89V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMINOREX FUMARATE, (S)-
Common Name English
2-OXAZOLAMINE, 4,5-DIHYDRO-5-PHENYL-, (2E)-2-BUTENEDIOATE (1:1)), (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
76959844
Created by admin on Sat Dec 16 09:03:24 GMT 2023 , Edited by admin on Sat Dec 16 09:03:24 GMT 2023
PRIMARY
FDA UNII
02K56MV89V
Created by admin on Sat Dec 16 09:03:24 GMT 2023 , Edited by admin on Sat Dec 16 09:03:24 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER