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Substance Name: 2,7,10,12-Tetraazatetradecanoic acid, 4-hydroxy-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-
RN: 165314-94-3
InChIKey: RWOAUOVLRZPDRW-DXUTUMGHSA-N

Molecular Formula

  • C36-H46-N6-O5-S2

Molecular Weight

  • 706.9284
 
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Names and Synonyms

  • 2,7,10,12-Tetraazatetradecanoic acid, 4-hydroxy-9-(1-methylethyl)-12-((2-(1-methylethyl)-4-thiazolyl)methyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S-(3R*,4R*,6R*,9R*))-

Registry Numbers

CAS Registry Number

  • 165314-94-3

System Generated Number

  • 0165314943

Structure Descriptors

InChI

1S/C36H46N6O5S2/c1-5-42(20-29-22-48-34(40-29)24(2)3)35(45)38-25(4)33(44)39-28(16-26-12-8-6-9-13-26)18-32(43)31(17-27-14-10-7-11-15-27)41-36(46)47-21-30-19-37-23-49-30/h6-15,19,22-25,28,31-32,43H,5,16-18,20-21H2,1-4H3,(H,38,45)(H,39,44)(H,41,46)/t25-,28-,31-,32-/m0/s1

InChIKey

RWOAUOVLRZPDRW-DXUTUMGHSA-N

Smiles

CCN(Cc1csc(n1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2ccccc2)C[C@@H]([C@H](Cc3ccccc3)NC(=O)OCc4cncs4)O