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Substance Name: 3-Piperidinecarboxylic acid, 1-(2-hydroxy-2-(3-methyl-1H-pyrrol-2-yl)ethyl)-4-((1-oxopropyl)phenylamino)-, methyl ester
RN: 156724-48-0
InChIKey: PSIIAXVYWZDJTG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H31-N3-O4

Molecular Weight

  • 413.5149
 
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Names and Synonyms

  • 3-Piperidinecarboxylic acid, 1-(2-hydroxy-2-(3-methyl-1H-pyrrol-2-yl)ethyl)-4-((1-oxopropyl)phenylamino)-, methyl ester

Registry Numbers

CAS Registry Number

  • 156724-48-0

System Generated Number

  • 0156724480

Structure Descriptors

InChI

1S/C23H31N3O4/c1-4-21(28)26(17-8-6-5-7-9-17)19-11-13-25(14-18(19)23(29)30-3)15-20(27)22-16(2)10-12-24-22/h5-10,12,18-20,24,27H,4,11,13-15H2,1-3H3

InChIKey

PSIIAXVYWZDJTG-UHFFFAOYSA-N

Smiles

CCC(=O)N(C1CCN(CC(O)c2[nH]ccc2C)CC1C(=O)OC)c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 intravenous 2510ug/kg (2.51mg/kg)   Zhongguo Yaoke Daxue Xuebao. Journal of China Pharmaceutical University. Vol. 25, Pg. 1, 1994.