Cas no 141363-91-9 (Glycine,(2S,3R,4S,5S)-tetrahydro-4-methoxy-5-methyl-2-[(1E,3E,5E)-1-methyl-1,3,5-heptatrien-1-yl]-2H-pyran-3-ylester)

Glycine,(2S,3R,4S,5S)-tetrahydro-4-methoxy-5-methyl-2-[(1E,3E,5E)-1-methyl-1,3,5-heptatrien-1-yl]-2H-pyran-3-ylester structure
141363-91-9 structure
Product Name:Glycine,(2S,3R,4S,5S)-tetrahydro-4-methoxy-5-methyl-2-[(1E,3E,5E)-1-methyl-1,3,5-heptatrien-1-yl]-2H-pyran-3-ylester
CAS No:141363-91-9
MF:C17H27NO4
MW:309.400585412979
CID:143462
PubChem ID:6438743
Update Time:2025-04-19

Glycine,(2S,3R,4S,5S)-tetrahydro-4-methoxy-5-methyl-2-[(1E,3E,5E)-1-methyl-1,3,5-heptatrien-1-yl]-2H-pyran-3-ylester Chemical and Physical Properties

Names and Identifiers

    • Glycine,(2S,3R,4S,5S)-tetrahydro-4-methoxy-5-methyl-2-[(1E,3E,5E)-1-methyl-1,3,5-heptatrien-1-yl]-2H-pyran-3-ylester
    • [4-methoxy-5-methyl-2-[(2E,4E,6E)-octa-2,4,6-trien-2-yl]oxan-3-yl] 2-aminoacetate
    • 3,7-anhydro-1,2,6-trideoxy-4-O-glycyl-2-[(2E,4E)-hexa-2,4-dien-1-ylidene]-6-methyl-5-O-methylheptitol
    • Glycine, tetrahydro-4-methoxy-5-methyl-2-(1-methyl-1,3,5-heptatrienyl)-2H-pyran-3-yl ester, (2S-(2-alpha(1E,3E,5E),3-beta,4-alpha,5-alpha))-
    • Lanomycin
    • 141363-91-9
    • Inchi: 1S/C17H27NO4/c1-5-6-7-8-9-12(2)16-17(22-14(19)10-18)15(20-4)13(3)11-21-16/h5-9,13,15-17H,10-11,18H2,1-4H3/b6-5+,8-7+,12-9+
    • InChI Key: DMLQRXAYJODTLF-XXDOZSIZSA-N
    • SMILES: O1CC(C)C(C(C1/C(=C/C=C/C=C/C)/C)OC(CN)=O)OC

Computed Properties

  • Exact Mass: 309.19400834g/mol
  • Monoisotopic Mass: 309.19400834g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 7
  • Complexity: 442
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 3
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.4
  • Topological Polar Surface Area: 70.8?2
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