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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H12N2O3
Molecular Weight 208.2139
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KYNURENINE

SMILES

N[C@@H](CC(=O)C1=C(N)C=CC=C1)C(O)=O

InChI

InChIKey=YGPSJZOEDVAXAB-QMMMGPOBSA-N
InChI=1S/C10H12N2O3/c11-7-4-2-1-3-6(7)9(13)5-8(12)10(14)15/h1-4,8H,5,11-12H2,(H,14,15)/t8-/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H12N2O3
Molecular Weight 208.2139
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
02JW4J5R44
Record Status Validated (UNII)
Record Version