FR 139317

CAS Registry Number®

142375-60-8
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CAS Name

FR 139317

Molecular Formula

C33H44N6O5

Molecular Mass

604.74

Cite this Page

FR 139317.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=142375-60-8 (retrieved 2024-07-08) (CAS RN: 142375-60-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C33H44N6O5/c1-22(2)18-26(37-33(44)39-16-10-4-5-11-17-39)30(40)35-27(19-23-21-38(3)29-14-7-6-13-25(23)29)31(41)36-28(32(42)43)20-24-12-8-9-15-34-24/h6-9,12-15,21-22,26-28H,4-5,10-11,16-20H2,1-3H3,(H,35,40)(H,36,41)(H,37,44)(H,42,43)/t26-,27+,28+/m0/s1

InChIKey

InChIKey=LIOKMIQQPDDTNO-UPRLRBBYSA-N

SMILES

C([C@@H](NC([C@@H](NC(=O)N1CCCCCC1)CC(C)C)=O)C(N[C@H](CC2=CC=CC=N2)C(O)=O)=O)C=3C=4C(N(C)C3)=CC=CC4

Canonical SMILES

O=C(O)C(NC(=O)C(NC(=O)C(NC(=O)N1CCCCCC1)CC(C)C)CC2=CN(C=3C=CC=CC32)C)CC4=NC=CC=C4

Other Names for this Substance

  • D-Alanine, N-[(hexahydro-1H-azepin-1-yl)carbonyl]-L-leucyl-1-methyl-D-tryptophyl-3-(2-pyridinyl)-
  • D-Alanine, N-[N-[N-[(hexahydro-1H-azepin-1-yl)carbonyl]-L-leucyl]-1-methyl-D-tryptophyl]-3-(2-pyridinyl)-
  • N-[(Hexahydro-1H-azepin-1-yl)carbonyl]-L-leucyl-1-methyl-D-tryptophyl-3-(2-pyridinyl)-D-alanine
  • FR 139317
  • PD 147953