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Substance Name: 2,4,7,12-Tetraazatridecan-13-oic acid, 10-hydroxy-2-methyl-5-(1-methylethyl)-1-(2-(2-methylpropyl)-4-thiazolyl)-3,6-dioxo-8,11-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (5S-(5R*,8R*,10R*,11R*))-
RN: 165315-32-2
InChIKey: AJUYWISGDSRRLY-JPECBQHSSA-N

Molecular Formula

  • C38-H50-N6-O5-S2

Molecular Weight

  • 734.982
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 165315-32-2

System Generated Number

  • 0165315322

Structure Descriptors

InChI

1S/C38H50N6O5S2/c1-25(2)16-34-40-30(23-50-34)21-44(5)37(47)43-35(26(3)4)36(46)41-29(17-27-12-8-6-9-13-27)19-33(45)32(18-28-14-10-7-11-15-28)42-38(48)49-22-31-20-39-24-51-31/h6-15,20,23-26,29,32-33,35,45H,16-19,21-22H2,1-5H3,(H,41,46)(H,42,48)(H,43,47)/t29-,32-,33-,35-/m0/s1

InChIKey

AJUYWISGDSRRLY-JPECBQHSSA-N

Smiles

CC(C)Cc1nc(cs1)CN(C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc2ccccc2)C[C@@H]([C@H](Cc3ccccc3)NC(=O)OCc4cncs4)O