L-phenylalanyl-L-valine | SBID = 1938 | Compound | Pubchem logo

Struc Structure

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Molecular Properties

Interactions: 3
PubChem TPSA/Å2: 92.4
Ertl TPSA/Å2:
Hydrophilicity (PubChem XLogP): -1.7
Hydrophilicity (Cheng XLogP3):
Charge: 0.0
Number of H-Bond Donors: 3.0
Number of H-Bond Acceptors: 4.0
Number of Stereogenic Bonds (E/Z): 0.0
Number of Stereogenic Atoms (R/S): 2.0
3D Volume/Å3: 210.8
Sum Formula: C14H20N2O3
M / g/mol: 264.32
Complexity: 312.0
Number of Conformers: 10.0

Identifiers

  • Tags: aromatic, amino acid, typical guest
  • Name: L-phenylalanyl-L-valine
  • Preferred Abbreviation: L-Phe-L-Val
  • IUPAC Name: (2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-methylbutanoic acid
  • CAS:
  • CID: 7359122
  • InChiKey: IEHDJWSAXBGJIP-RYUDHWBXSA-N
  • InChi: InChI=1S/C14H20N2O3/c1-9(2)12(14(18)19)16-13(17)11(15)8-10-6-4-3-5-7-10/h3-7,9,11-12H,8,15H2,1-2H3,(H,16,17)(H,18,19)/t11-,12-/m0/s1
  • CanoSmiles: CC(C)C(C(=O)O)NC(=O)C(CC1=CC=CC=C1)N
  • IsoSmiles: CC(C)[C@@H](C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)N