Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-((4-(3-(4-morpholinyl)-3-oxopropyl)phenyl)methyl)-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-
RN: 175233-60-0
InChIKey: SGSVELRCCSUWEU-GASGPIRDSA-N

Molecular Formula

  • C37-H56-N4-O8

Molecular Weight

  • 684.8694
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • (1S-(1R,2S(2S,3R)))-(3-((3-(((1,1-Dimethylethoxy)-carbonyl)amino)-2-hydroxy-4-(4-(3-(4-morpholinyl)-3-oxopropyl)phenyl)butyl)amino)-2-hydroxy-1-(phenylmethyl)propyl)carbamic Acid, 1,1-Dimethylethyl ester
  • Phe Aminodiol isostere

Systematic Name

  • 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-((4-(3-(4-morpholinyl)-3-oxopropyl)phenyl)methyl)-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-

Registry Numbers

CAS Registry Number

  • 175233-60-0

System Generated Number

  • 0175233600

Structure Descriptors

InChI

1S/C37H56N4O8/c1-36(2,3)48-34(45)39-29(22-27-10-8-7-9-11-27)31(42)24-38-25-32(43)30(40-35(46)49-37(4,5)6)23-28-14-12-26(13-15-28)16-17-33(44)41-18-20-47-21-19-41/h7-15,29-32,38,42-43H,16-25H2,1-6H3,(H,39,45)(H,40,46)/t29-,30-,31+,32+/m0/s1

InChIKey

SGSVELRCCSUWEU-GASGPIRDSA-N

Smiles

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](CNC[C@H]([C@H](Cc2ccc(cc2)CCC(=O)N3CCOCC3)NC(=O)OC(C)(C)C)O)O