Cas no 3303-46-6 (L-Valine, D-alanyl-)

L-Valine, D-alanyl- structure
L-Valine, D-alanyl- structure
Product Name:L-Valine, D-alanyl-
CAS No:3303-46-6
MF:C8H16N2O3
MW:188.224242210388
CID:320048
PubChem ID:137276
Update Time:2025-04-19

L-Valine, D-alanyl- Chemical and Physical Properties

Names and Identifiers

    • L-Valine, D-alanyl-
    • (2S)-2-[[(2R)-2-aminopropanoyl]amino]-3-methylbutanoic acid
    • (S)-2-[(S)-2-Aminopropanoyl]-3-methylbutyric acid
    • ALA-VAL
    • Ala-Val-OH
    • dipeptide of L-alanine and L-valine
    • H-(L)-Ala-(L)-Val-OH
    • L-Ala-L-Val-OH
    • L-alanine-L-valine
    • L-ALANYL-L-VALINE
    • L-ALA-VAL
    • L-Valine, N-L-alanyl-
    • N-Alanylvaline
    • N-L-alanyl-L-valine
    • Alanylvaline (DL)
    • CHEBI:182838
    • NSC89603
    • DTXSID00941964
    • SCHEMBL595438
    • 2-(2-aminopropanoylamino)-3-methylbutanoic acid
    • NSC-89603
    • MFCD00038163
    • A0192
    • LIWMQSWFLXEGMA-UHFFFAOYSA-N
    • NSC-89659
    • 2-(2-aminopropanamido)-3-methylbutanoic acid
    • Valine, alanyl-
    • N-(2-Amino-1-hydroxypropylidene)valine
    • D88227
    • N-(2-Aminopropanoyl)valine
    • 1999-46-8
    • 3303-46-6
    • NSC 89659
    • AKOS009159163
    • NSC-206294
    • J-018983
    • NCIOpen2_001297
    • FT-0738899
    • H-DL-Ala-DL-Val-OH
    • A879899
    • NSC89659
    • NSC206294
    • N-(2-Aminopropanoyl)valine #
    • dl-Alanyl-dl-valine
    • BAA99946
    • d,l-alanyl-d,l-valine
    • D-ALANYL-D-VALINE
    • DL-Alanyl-DL-valine (H-DL-Ala-DL-Val-OH)
    • FT-0634768
    • Inchi: 1S/C8H16N2O3/c1-4(2)6(8(12)13)10-7(11)5(3)9/h4-6H,9H2,1-3H3,(H,10,11)(H,12,13)
    • InChI Key: LIWMQSWFLXEGMA-UHFFFAOYSA-N
    • SMILES: OC(C(C(C)C)NC(C(C)N)=O)=O

Computed Properties

  • Exact Mass: 188.11618
  • Monoisotopic Mass: 188.11609238g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 204
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -3
  • Topological Polar Surface Area: 92.4?2

Experimental Properties

  • PSA: 92.42

L-Valine, D-alanyl- Related Literature

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