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Substance Name: Nitrosofolic acid
RN: 29291-35-8
UNII: QR96MOG8SM
InChIKey: QPQDSWYBXPBZPJ-LBPRGKRZSA-N

Molecular Formula

  • C19-H18-N8-O7

Molecular Weight

  • 470.4
 

Classification Codes

Classification Codes

  • Mutation Data
  • Tumor Data

Superlist Classification Code

  • Overall Carcinogenic Evaluation: Group 3
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Names and Synonyms

Name of Substance

  • Nitrosofolic acid

Synonyms

  • CCRIS 466
  • N-Nitrosofolic acid
  • Nitrosofolic acid
  • UNII-QR96MOG8SM

Systematic Names

  • Glutamic acid, N-nitroso-N-pteroyl-, L-
  • L-Glutamic acid, N-(4-(((2-amino-1,4-dihydro-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-N-nitroso-
  • N-Nitrosofolic acid

Superlist Name

  • N-Nitrosofolic acid

Registry Numbers

CAS Registry Number

  • 29291-35-8

FDA UNII

  • QR96MOG8SM

System Generated Number

  • 0029291358

Structure Descriptors

InChI

1S/C19H18N8O7/c20-19-24-15-14(16(30)25-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)17(31)27(26-34)12(18(32)33)5-6-13(28)29/h1-4,8,12,21H,5-7H2,(H,28,29)(H,32,33)(H3,20,22,24,25,30)/t12-/m0/s1

InChIKey

QPQDSWYBXPBZPJ-LBPRGKRZSA-N

Smiles

c1cc(ccc1NCc1c[nH]c2nc(N)nc(=O)c2n1)C(N(N=O)[C@@H](CCC(O)=O)C(=O)O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 327mg/kg (327mg/kg) LIVER: TUMORS Cancer Research. Vol. 35, Pg. 1981, 1975.