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Substance Name: 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((((((1,1'-biphenyl)-4-ylcarbonyl)hydrazono)acetyl)amino)phenylacetyl)amino)-3,3-dimethyl-7-oxo-, (2S-(2-alpha,5-alpha,6-beta(S*)))-
RN: 143729-89-9
InChIKey: BBIFROPXHXCFHG-TXRIQHHCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C31-H29-N5-O6-S

Molecular Weight

  • 599.6651
 
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Names and Synonyms

  • 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((((((1,1'-biphenyl)-4-ylcarbonyl)hydrazono)acetyl)amino)phenylacetyl)amino)-3,3-dimethyl-7-oxo-, (2S-(2-alpha,5-alpha,6-beta(S*)))-

Registry Numbers

CAS Registry Number

  • 143729-89-9

System Generated Number

  • 0143729899

Structure Descriptors

InChI

1S/C31H29N5O6S/c1-31(2)25(30(41)42)36-28(40)24(29(36)43-31)34-27(39)23(20-11-7-4-8-12-20)33-22(37)17-32-35-26(38)21-15-13-19(14-16-21)18-9-5-3-6-10-18/h3-17,23-25,29H,1-2H3,(H,33,37)(H,34,39)(H,35,38)(H,41,42)/b32-17+/t23?,24-,25+,29-/m1/s1

InChIKey

BBIFROPXHXCFHG-TXRIQHHCSA-N

Smiles

CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(c3ccccc3)NC(=O)/C=N/NC(=O)c4ccc(cc4)c5ccccc5)C(=O)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intravenous > 250mg/kg (250mg/kg)   Pharmazie. Vol. 47, Pg. 529, 1992.