Cas no 38575-18-7 (all-trans-arachidonic acid methyl ester)

all-trans-arachidonic acid methyl ester structure
38575-18-7 structure
Product Name:all-trans-arachidonic acid methyl ester
CAS No:38575-18-7
MF:C21H34O2
MW:318.493466854095
CID:2020971
PubChem ID:5367365
Update Time:2025-04-21

all-trans-arachidonic acid methyl ester Chemical and Physical Properties

Names and Identifiers

    • all-trans-arachidonic acid methyl ester
    • arachidonic acid methyl ester
    • Arachidonsaeure-methylester
    • eicosa-5,8,11,14-tetraenoic acid methyl ester
    • Eicosa-5,8,11,14-tetraensaeure-methylester
    • methyl arachidate
    • methyl ester of arachidonic acid
    • 5,8,11,14-Eicosatetraenoic acid, methyl ester, (5E,8E,11E,14E)-
    • Methyl (5E,8E,11E,14E)-eicosatetraenoate
    • JWS9K7WM5U
    • SCHEMBL23821
    • 5,8,11,14-Eicosatetraenoic acid, methyl ester
    • Methyl-5,8,11,14-eicosatetraenoate
    • SCHEMBL23152374
    • Methyl 5,8,11,14-eicosatetraenoate
    • UNII-JWS9K7WM5U
    • 38575-18-7
    • CAA56689
    • (5Z,8Z,11Z,14Z)-Methyl icosa-5,8,11,14-tetraenoate
    • Inchi: 1S/C21H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h7-8,10-11,13-14,16-17H,3-6,9,12,15,18-20H2,1-2H3/b8-7+,11-10+,14-13+,17-16+
    • InChI Key: OFIDNKMQBYGNIW-SHDWVJIKSA-N
    • SMILES: O(C)C(CCC/C=C/C/C=C/C/C=C/C/C=C/CCCCC)=O

Computed Properties

  • Exact Mass: 318.255880323g/mol
  • Monoisotopic Mass: 318.255880323g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 15
  • Complexity: 375
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 4
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 6.6
  • Topological Polar Surface Area: 26.3?2
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