Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-(phenylmethyl)-9-(2-quinolinylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-(1S-(1R*,2S*(2S*,3R*)))-(3-((3-(((1,1-Dimethylethoxy)-carbonyl)amino)-2-hydroxy-4-phenylbutyl)amino)-2-hydroxy-1-(6-quinolinylmethyl)propyl)carbamic Acid, 1,1-Dimethylethyl ester
RN: 175233-59-7
InChIKey: SCFUZBGSNDDHBF-QUAHOIDUSA-N

Molecular Formula

  • C33-H46-N4-O6

Molecular Weight

  • 594.7484
 
* 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-phenylbutyl)amino)-2-hydroxy-1-(6-quinolinylmethyl)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-11-oxo-3-(phenylmethyl)-9-(2-quinolinylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-(1S-(1R*,2S*(2S*,3R*)))-(3-((3-(((1,1-Dimethylethoxy)-carbonyl)amino)-2-hydroxy-4-phenylbutyl)amino)-2-hydroxy-1-(6-quinolinylmethyl)propyl)carbamic Acid, 1,1-Dimethylethyl ester

Registry Numbers

CAS Registry Number

  • 175233-59-7

System Generated Number

  • 0175233597

Structure Descriptors

InChI

1S/C33H46N4O6/c1-32(2,3)42-30(40)36-26(18-22-11-8-7-9-12-22)28(38)20-34-21-29(39)27(37-31(41)43-33(4,5)6)19-23-14-15-25-24(17-23)13-10-16-35-25/h7-17,26-29,34,38-39H,18-21H2,1-6H3,(H,36,40)(H,37,41)/t26-,27-,28+,29+/m0/s1

InChIKey

SCFUZBGSNDDHBF-QUAHOIDUSA-N

Smiles

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](CNC[C@H]([C@H](Cc2ccc3c(c2)cccn3)NC(=O)OC(C)(C)C)O)O