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Substance Name: 3-Oxykynurenine
RN: 32447-45-3
InChIKey: PLLBOFKHLCBWQT-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C20-H22-N4-O7

Molecular Weight

  • 430.415
 
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Names and Synonyms

Results Name

  • 3-Oxykynurenine

Synonym

  • 3-Oxykynurenine

Systematic Name

  • Benzenebutanoic acid, beta,beta'-oxybis(alpha,2-diamino-gamma-oxo-

Registry Numbers

CAS Registry Number

  • 32447-45-3

System Generated Number

  • 0032447453

Structure Descriptors

InChI

1S/C20H22N4O7/c21-11-7-3-1-5-9(11)15(25)17(13(23)19(27)28)31-18(14(24)20(29)30)16(26)10-6-2-4-8-12(10)22/h1-8,13-14,17-18H,21-24H2,(H,27,28)(H,29,30)

InChIKey

PLLBOFKHLCBWQT-UHFFFAOYSA-N

Smiles

O([C@@H]([C@@H](C(=O)O)N)C(c1c(cccc1)N)=O)[C@@H]([C@@H](C(=O)O)N)C(c1c(cccc1)N)=O