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Substance Name: 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2-amino-4-thiazolyl)(((1,4-dihydro-1,5-dihydroxy-4-oxo-2-pyridinyl)carbonyl)amino)acetyl)amino)-3-(((2,3-dihydro-1H-indol-5-yl)thio)methyl)-8-oxo-, (6R-(6-alpha,7-beta))-
RN: 108376-15-4
InChIKey: USIHERORABLSHM-PIATZHDUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H25-N7-O8-S3

Molecular Weight

  • 671.7335
 
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Names and Synonyms

  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2-amino-4-thiazolyl)(((1,4-dihydro-1,5-dihydroxy-4-oxo-2-pyridinyl)carbonyl)amino)acetyl)amino)-3-(((2,3-dihydro-1H-indol-5-yl)thio)methyl)-8-oxo-, (6R-(6-alpha,7-beta))-

Registry Numbers

CAS Registry Number

  • 108376-15-4

System Generated Number

  • 0108376154

Structure Descriptors

InChI

1S/C27H25N7O8S3/c28-27-30-15(10-45-27)19(31-22(37)16-6-17(35)18(36)7-33(16)42)23(38)32-20-24(39)34-21(26(40)41)12(9-44-25(20)34)8-43-13-1-2-14-11(5-13)3-4-29-14/h1-2,5-7,10,19-20,25,29,36,42H,3-4,8-9H2,(H2,28,30)(H,31,37)(H,32,38)(H,40,41)/t19?,20-,25-/m1/s1

InChIKey

USIHERORABLSHM-PIATZHDUSA-N

Smiles

c1cc2c(cc1SCC3=C(N4[C@@H]([C@@H](C4=O)NC(=O)C(c5csc(n5)N)NC(=O)c6cc(=O)c(cn6O)O)SC3)C(=O)O)CCN2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous 2gm/kg (2000mg/kg)   Journal of Antibiotics. Vol. 43, Pg. 174, 1990.