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Substance Name: L-Alanine, N-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)-
RN: 117125-43-6
InChIKey: UTTNNMKDQVGZAU-CHPOKUKFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H17-N-O2-S

Molecular Weight

  • 299.3923
 
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Names and Synonyms

Synonyms

  • 2-(6,11-Dihydrodibenzo(b,e)thiepin-11-ylamino)propionic acid
  • BRN 4515329

Systematic Name

  • L-Alanine, N-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)-

Registry Numbers

CAS Registry Number

  • 117125-43-6

System Generated Number

  • 0117125436

Structure Descriptors

InChI

1S/C17H17NO2S/c1-11(17(19)20)18-16-13-7-3-2-6-12(13)10-21-15-9-5-4-8-14(15)16/h2-9,11,16,18H,10H2,1H3,(H,19,20)/t11-,16?/m0/s1

InChIKey

UTTNNMKDQVGZAU-CHPOKUKFSA-N

Smiles

C[C@@H](C(=O)O)NC1c2ccccc2CSc3c1cccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 53, Pg. 860, 1988.