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Substance Name: 4H-Pyran-2-carboxylic acid, 5-hydroxy-6-(((2-hydroxyethyl)amino)methyl)-4-oxo-
RN: 66556-10-3
InChIKey: SYWSDJVDSREHOG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H11-N-O6

Molecular Weight

  • 229.1869
 
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Names and Synonyms

Synonym

  • 6-(Hydroxethylaminomethyl)comenic acid

Systematic Name

  • 4H-Pyran-2-carboxylic acid, 5-hydroxy-6-(((2-hydroxyethyl)amino)methyl)-4-oxo-

Registry Numbers

CAS Registry Number

  • 66556-10-3

System Generated Number

  • 0066556103

Structure Descriptors

InChI

1S/C9H11NO6/c11-2-1-10-4-7-8(13)5(12)3-6(16-7)9(14)15/h3,10-11,13H,1-2,4H2,(H,14,15)

InChIKey

SYWSDJVDSREHOG-UHFFFAOYSA-N

Smiles

OCCNCC1=C(O)C(=O)C=C(O1)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 12, Pg. 230, 1978.