Cas no 30825-69-5 (Maximolide)

Maximolide structure
Maximolide structure
Product Name:Maximolide
CAS No:30825-69-5
MF:C15H20O4
MW:264.316905021667
CID:305378
PubChem ID:14589063
Update Time:2024-02-29

Maximolide Chemical and Physical Properties

Names and Identifiers

    • Azuleno[4,5-b]furan-2,8(3H,4H)-dione,octahydro-4-hydroxy-3,9-dimethyl-6-methylene-, (3S,3aR,4S,6aR,9S,9aR,9bR)-
    • (3aβ,6aβ,9aβ,9bα)-3β,9β-Dimethyl-4β-hydroxy-6-methylenedodecahydroazuleno[4,5-b]furan-2,8-dione
    • 4bH-Guai-10(14)-en-12-oic acid, 6a,8a-dihydroxy-3-oxo-, 12,6-lactone, (11S)- (8CI)
    • Azuleno[4,5-b]furan-2,8(3H,4H)-dione,octahydro-4-hydroxy-3,9-dimethyl-6-methylene-, [3S-(3a,3aa,4a,6aa,9a,9aa,9bb)]-
    • Isoamberboin
    • Maximolide
    • DTXSID901109917
    • 30825-69-5
    • (3S,3aR,4S,6aR,9S,9aR,9bR)-Octahydro-4-hydroxy-3,9-dimethyl-6-methyleneazuleno[4,5-b]furan-2,8(3H,4H)-dione
    • CHEBI:174473
    • 4-hydroxy-3,9-dimethyl-6-methylidene-dodecahydroazuleno[4,5-b]furan-2,8-dione
    • SCHEMBL10307511
    • 4-hydroxy-3,9-dimethyl-6-methylidene-3a,4,5,6a,7,9,9a,9b-octahydro-3H-azuleno[4,5-b]uran-2,8-dione
    • Inchi: 1S/C15H20O4/c1-6-4-11(17)13-8(3)15(18)19-14(13)12-7(2)10(16)5-9(6)12/h7-9,11-14,17H,1,4-5H2,2-3H3/t7-,8+,9+,11+,12+,13-,14-/m1/s1
    • InChI Key: ZAPNUFCAIXITRW-LUQFHCQZSA-N
    • SMILES: O1C([C@@H](C)[C@@H]2[C@H](CC(=C)[C@@H]3CC([C@@H](C)[C@@H]3[C@@H]12)=O)O)=O

Computed Properties

  • Exact Mass: 264.13615911g/mol
  • Monoisotopic Mass: 264.13615911g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 0
  • Complexity: 455
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 7
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 63.6
  • XLogP3: 0.9
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