GGRRGGY Heptapeptide | SBID = 2582 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 1
PubChem TPSA/Å2:
Ertl TPSA/Å2: 381.95
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3): -5.29
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: C30H49N13O9
M / g/mol: 735.79176
Complexity:
Number of Conformers:

Identifiers

  • Tags: peptide
  • Name: GGRRGGY Heptapeptide
  • Preferred Abbreviation: GGRRGGY
  • IUPAC Name:
  • CAS:
  • CID: -1140
  • InChiKey: RMDXKEODRBNTRJ-UHFFFAOYSA-N
  • InChi: InChI=1S/C30H49N13O9/c31-13-22(45)38-15-24(47)41-20(5-3-11-37-30(34)35)27(50)43-19(4-1-2-10-36-29(32)33)26(49)40-14-23(46)39-16-25(48)42-21(28(51)52)12-17-6-8-18(44)9-7-17/h6-9,19-21,44H,1-5,10-16,31H2,(H,38,45)(H,39,46)(H,40,49)(H,41,47)(H,42,48)(H,43,50)(H,51,52)(H4,32,33,36)(H4,34,35,37)
  • 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)CCCCNC(=N)N)CCCNC(=N)N
  • IsoSmiles: NCC(NCC(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCCNC(N)=N)C(NCC(NCC(N[C@H](C(O)=O)CC1=CC=C(O)C=C1)=O)=O)=O)=O)=O)=O