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Substance Name: (1'S,2'S,8S,11R)-11-(2'-(((1,1-Dimethylethoxy)carbonyl)amino)-1'-hydroxy-3'-phenylprop-1'-yl)-8-(1-methylethyl)-6,9,12-triaza-1-oxa-7,10-dioxo(13)metacyclophane
RN: 180968-40-5
InChIKey: KECRHHMVDCUMCW-YVHASNINSA-N

Molecular Formula

  • C32-H46-N4-O6

Molecular Weight

  • 582.7374
 
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Names and Synonyms

  • (1'S,2'S,8S,11R)-11-(2'-(((1,1-Dimethylethoxy)carbonyl)amino)-1'-hydroxy-3'-phenylprop-1'-yl)-8-(1-methylethyl)-6,9,12-triaza-1-oxa-7,10-dioxo(13)metacyclophane

Registry Numbers

CAS Registry Number

  • 180968-40-5

System Generated Number

  • 0180968405

Structure Descriptors

InChI

1S/C32H46N4O6/c1-21(2)26-29(38)33-16-9-10-17-41-24-15-11-14-23(18-24)20-34-27(30(39)36-26)28(37)25(19-22-12-7-6-8-13-22)35-31(40)42-32(3,4)5/h6-8,11-15,18,21,25-28,34,37H,9-10,16-17,19-20H2,1-5H3,(H,33,38)(H,35,40)(H,36,39)/t25-,26-,27+,28+/m0/s1

InChIKey

KECRHHMVDCUMCW-YVHASNINSA-N

Smiles

CC(C)[C@H]1C(=O)NCCCCOc2cccc(c2)CN[C@@H](C(=O)N1)[C@@H]([C@H](Cc3ccccc3)NC(=O)OC(C)(C)C)O