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Substance Name: 15-Oxa-2,8,11-triazaheptadecanoic acid, 4-hydroxy-9-(1-methylethyl)-7,10-dioxo-3-(phenylmethyl)-6-((2,3,4-trimethoxyphenyl)methyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4R*,6S*,9R*))-
RN: 178047-87-5
InChIKey: JXHZEBDHDADUQD-NYTDTBNFSA-N

Molecular Formula

  • C37-H57-N3-O9

Molecular Weight

  • 687.8693
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 178047-87-5

System Generated Number

  • 0178047875

Structure Descriptors

InChI

1S/C37H57N3O9/c1-10-48-20-14-19-38-35(43)31(24(2)3)40-34(42)27(22-26-17-18-30(45-7)33(47-9)32(26)46-8)23-29(41)28(21-25-15-12-11-13-16-25)39-36(44)49-37(4,5)6/h11-13,15-18,24,27-29,31,41H,10,14,19-23H2,1-9H3,(H,38,43)(H,39,44)(H,40,42)/t27-,28+,29+,31+/m1/s1

InChIKey

JXHZEBDHDADUQD-NYTDTBNFSA-N

Smiles

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