GAFKAGY Heptapeptide | SBID = 2570 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 1
PubChem TPSA/Å2:
Ertl TPSA/Å2: 284.17
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3): -1.85
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: C34H48N8O9
M / g/mol: 712.79312
Complexity:
Number of Conformers:

Identifiers

  • Tags: peptide
  • Name: GAFKAGY Heptapeptide
  • Preferred Abbreviation: GAFKAGY
  • IUPAC Name:
  • CAS:
  • CID: -1128
  • InChiKey: TUMWXESAVCSMPD-UHFFFAOYSA-N
  • InChi: InChI=1S/C34H48N8O9/c1-20(30(46)37-19-29(45)40-27(34(50)51)17-23-11-13-24(43)14-12-23)39-32(48)25(10-6-7-15-35)41-33(49)26(16-22-8-4-3-5-9-22)42-31(47)21(2)38-28(44)18-36/h3-5,8-9,11-14,20-21,25-27,43H,6-7,10,15-19,35-36H2,1-2H3,(H,37,46)(H,38,44)(H,39,48)(H,40,45)(H,41,49)(H,42,47)(H,50,51)
  • CanoSmiles: NCCCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CN)C)Cc1ccccc1
  • IsoSmiles: NCC(N[C@@H](C)C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CCCCN)C(N[C@@H](C)C(NCC(N[C@H](C(O)=O)CC2=CC=C(O)C=C2)=O)=O)=O)=O)=O)=O