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Substance Name: 2-Oxa-4,7,12-triazatridecan-13-oic acid, 10-hydroxy-5-methyl-1-(2-(1-methylethyl)-4-thiazolyl)-3,6-dioxo-8,11-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (5S-(5R*,8R*,10R*,11R*))-
RN: 165314-97-6
InChIKey: NUBZZRKMTMEDBQ-LCKUPXPRSA-N

Molecular Formula

  • C34-H41-N5-O6-S2

Molecular Weight

  • 679.8589
 
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Names and Synonyms

  • 2-Oxa-4,7,12-triazatridecan-13-oic acid, 10-hydroxy-5-methyl-1-(2-(1-methylethyl)-4-thiazolyl)-3,6-dioxo-8,11-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (5S-(5R*,8R*,10R*,11R*))-

Registry Numbers

CAS Registry Number

  • 165314-97-6

System Generated Number

  • 0165314976

Structure Descriptors

InChI

1S/C34H41N5O6S2/c1-22(2)32-38-27(20-46-32)18-44-33(42)36-23(3)31(41)37-26(14-24-10-6-4-7-11-24)16-30(40)29(15-25-12-8-5-9-13-25)39-34(43)45-19-28-17-35-21-47-28/h4-13,17,20-23,26,29-30,40H,14-16,18-19H2,1-3H3,(H,36,42)(H,37,41)(H,39,43)/t23-,26-,29-,30-/m0/s1

InChIKey

NUBZZRKMTMEDBQ-LCKUPXPRSA-N

Smiles

C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C[C@@H]([C@H](Cc2ccccc2)NC(=O)OCc3cncs3)O)NC(=O)OCc4csc(n4)C(C)C