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Substance Name: 2,4,7,12-Tetraazatridecan-13-oic acid, 2-cyclopropyl-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: 165315-05-9
InChIKey: UUEYXVABPDEFJP-KONZEVEYSA-N

Molecular Formula

  • C37-H46-N6-O5-S2

Molecular Weight

  • 718.9394
 
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Names and Synonyms

  • 2,4,7,12-Tetraazatridecan-13-oic acid, 2-cyclopropyl-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

  • 165315-05-9

System Generated Number

  • 0165315059

Structure Descriptors

InChI

1S/C37H46N6O5S2/c1-24(2)35-41-29(22-49-35)20-43(30-14-15-30)36(46)39-25(3)34(45)40-28(16-26-10-6-4-7-11-26)18-33(44)32(17-27-12-8-5-9-13-27)42-37(47)48-21-31-19-38-23-50-31/h4-13,19,22-25,28,30,32-33,44H,14-18,20-21H2,1-3H3,(H,39,46)(H,40,45)(H,42,47)/t25-,28-,32-,33-/m0/s1

InChIKey

UUEYXVABPDEFJP-KONZEVEYSA-N

Smiles

C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C[C@@H]([C@H](Cc2ccccc2)NC(=O)OCc3cncs3)O)NC(=O)N(Cc4csc(n4)C(C)C)C5CC5