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Substance Name: Carbamoyl mycophenolic acid ethyl ester
RN: 40336-43-4
InChIKey: OGZXNIUMCRIYRK-IZZDOVSWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H25-N-O8

Molecular Weight

  • 391.4175
 
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Names and Synonyms

Name of Substance

  • Carbamoyl mycophenolic acid ethyl ester

Systematic Names

  • 4-Hexenoic acid, 6-(4-((aminocarbonyl)oxy)-1,3-dihydro-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, ethyl ester, (E)-
  • 4-Hexenoic acid, 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-, ethyl ester, carbamate (ester) (E)-

Registry Numbers

CAS Registry Number

  • 40336-43-4

System Generated Number

  • 0040336434

Structure Descriptors

InChI

1S/C20H25NO7/c1-5-26-15(22)9-7-11(2)6-8-13-17(25-4)12(3)14-10-27-19(23)16(14)18(13)28-20(21)24/h6H,5,7-10H2,1-4H3,(H2,21,24)/b11-6+

InChIKey

OGZXNIUMCRIYRK-IZZDOVSWSA-N

Smiles

CCOC(=O)CC/C(=C/Cc1c(c(c2c(c1OC(=O)N)C(=O)OC2)C)OC)/C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 oral 3080mg/kg (3080mg/kg)   Journal of Antibiotics. Vol. 29, Pg. 286, 1976.