GGLYGGY Heptapeptide | SBID = 2580 | Compound | Custom Molecule

Molecular Properties

Interactions: 1
PubChem TPSA/Å2:
Ertl TPSA/Å2: 278.38
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3): -1.45
Charge: 0.0
Number of H-Bond Donors: 0.0
Number of H-Bond Acceptors: 0.0
Number of Stereogenic Bonds (E/Z):
Number of Stereogenic Atoms (R/S):
3D Volume/Å3:
Sum Formula: C32H43N7O10
M / g/mol: 685.72472
Complexity:
Number of Conformers:

Identifiers

  • Tags: peptide
  • Name: GGLYGGY Heptapeptide
  • Preferred Abbreviation: GGLYGGY
  • IUPAC Name:
  • CAS:
  • CID: -1138
  • InChiKey: AIKXKXLPCGDLTL-UHFFFAOYSA-N
  • InChi: InChI=1S/C32H43N7O10/c1-18(2)11-23(37-28(44)16-34-26(42)14-33)31(47)39-24(12-19-3-7-21(40)8-4-19)30(46)36-15-27(43)35-17-29(45)38-25(32(48)49)13-20-5-9-22(41)10-6-20/h3-10,18,23-25,40-41H,11-17,33H2,1-2H3,(H,34,42)(H,35,43)(H,36,46)(H,37,44)(H,38,45)(H,39,47)(H,48,49)
  • CanoSmiles: NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CC(C)C
  • IsoSmiles: NCC(NCC(N[C@@H](CC(C)C)C(N[C@@H](CC1=CC=C(O)C=C1)C(NCC(NCC(N[C@H](C(O)=O)CC2=CC=C(O)C=C2)=O)=O)=O)=O)=O)=O