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Substance Name: 2-Oxa-6,9,15-triazahexadecan-16-oic acid, 13-hydroxy-8-(1-methylethyl)-7,10-dioxo-14-(phenylmethyl)-11-((2,3,4-trimethoxyphenyl)methyl)-,1,1-dimethylethyl ester, (8S-(8R*,11S*,13R*,14R*))-
RN: 178047-86-4
InChIKey: DWOMOTUAJLXZBO-KGVZJERPSA-N

Molecular Formula

  • C36-H55-N3-O9

Molecular Weight

  • 673.8425
 
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Names and Synonyms

  • 2-Oxa-6,9,15-triazahexadecan-16-oic acid, 13-hydroxy-8-(1-methylethyl)-7,10-dioxo-14-(phenylmethyl)-11-((2,3,4-trimethoxyphenyl)methyl)-,1,1-dimethylethyl ester, (8S-(8R*,11S*,13R*,14R*))-

Registry Numbers

CAS Registry Number

  • 178047-86-4

System Generated Number

  • 0178047864

Structure Descriptors

InChI

1S/C36H55N3O9/c1-23(2)30(34(42)37-18-13-19-44-6)39-33(41)26(21-25-16-17-29(45-7)32(47-9)31(25)46-8)22-28(40)27(20-24-14-11-10-12-15-24)38-35(43)48-36(3,4)5/h10-12,14-17,23,26-28,30,40H,13,18-22H2,1-9H3,(H,37,42)(H,38,43)(H,39,41)/t26-,27+,28+,30+/m1/s1

InChIKey

DWOMOTUAJLXZBO-KGVZJERPSA-N

Smiles

CC(C)[C@@H](C(=O)NCCCOC)NC(=O)[C@H](Cc1ccc(c(c1OC)OC)OC)C[C@@H]([C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O