Cas no 88192-99-8 (Carbamic acid,N-[(1E,5R)-5-[3-[(2E,4E)-2,5-dimethyl-1-oxo-2,4-nonadien-1-yl]-4-hydroxy-2-oxo-2H-pyran-6-yl]-1-hexen-1-yl]-,methyl ester)

Carbamic acid,N-[(1E,5R)-5-[3-[(2E,4E)-2,5-dimethyl-1-oxo-2,4-nonadien-1-yl]-4-hydroxy-2-oxo-2H-pyran-6-yl]-1-hexen-1-yl]-,methyl ester structure
88192-99-8 structure
Product Name:Carbamic acid,N-[(1E,5R)-5-[3-[(2E,4E)-2,5-dimethyl-1-oxo-2,4-nonadien-1-yl]-4-hydroxy-2-oxo-2H-pyran-6-yl]-1-hexen-1-yl]-,methyl ester
CAS No:88192-99-8
MF:C24H33NO6
MW:431.521927595139
CID:723531
PubChem ID:135423114
Update Time:2025-04-19

Carbamic acid,N-[(1E,5R)-5-[3-[(2E,4E)-2,5-dimethyl-1-oxo-2,4-nonadien-1-yl]-4-hydroxy-2-oxo-2H-pyran-6-yl]-1-hexen-1-yl]-,methyl ester Chemical and Physical Properties

Names and Identifiers

    • Carbamic acid,N-[(1E,5R)-5-[3-[(2E,4E)-2,5-dimethyl-1-oxo-2,4-nonadien-1-yl]-4-hydroxy-2-oxo-2H-pyran-6-yl]-1-hexen-1-yl]-,methyl ester
    • Carbamic acid,N-[(1E,5R)-5-[3-[(2E,4E)-2,5-dimethyl-1-oxo-2,4-nonadien-1-yl]-4-hydroxy-2-oxo-2H-pyran-6-yl]-1-hexen-1-yl]-,me
    • methyl N-[(E,5R)-5-[(5E)-5-[(2E,4E)-1-hydroxy-2,5-dimethylnona-2,4-dienylidene]-4,6-dioxopyran-2-yl]hex-1-enyl]carbamate
    • myxopyronin B
    • CHEMBL247042
    • 4C4
    • CHEBI:188570
    • BRN 5162839
    • Carbamic acid, (5-(3-(2,5-dimethyl-1-oxo-2,4-nonadienyl)-4-hydroxy-2-oxo-2H-pyran-6-yl)-1-hexenyl)-, methyl ester, (R-(E,E,E))-
    • methyl N-[(E,5R)-5-[5-[(2E,4E)-2,5-dimethylnona-2,4-dienoyl]-4-hydroxy-6-oxopyran-2-yl]hex-1-enyl]carbamate
    • methyl [(1E,5R)-5-{3-[(2E,4E)-2,5-dimethylnona-2,4-dienoyl]-4-hydroxy-2-oxo-2H-pyran-6-yl}hex-1-en-1-yl]carbamate
    • 88192-99-8
    • Inchi： 1S/C24H33NO6/c1-6-7-10-16(2)12-13-18(4)22(27)21-19(26)15-20(31-23(21)28)17(3)11-8-9-14-25-24(29)30-5/h9,12-15,17,26H,6-8,10-11H2,1-5H3,(H,25,29)/b14-9+,16-12+,18-13+/t17-/m1/s1
    • InChI Key： SPQDIDVJAZFBRL-WXFBSNOUSA-N
    • SMILES： O1C(C(C(/C(/C)=C/C=C(\C)/CCCC)=O)=C(C=C1[C@H](C)CC/C=C/NC(=O)OC)O)=O

Computed Properties

  • Exact Mass: 431.231
  • Monoisotopic Mass: 431.231
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 31
  • Rotatable Bond Count: 11
  • Complexity: 829
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 4
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 102A^2
  • XLogP3: 5.9

Experimental Properties

  • Density: 1.139
  • Boiling Point: 579.2°C at 760 mmHg
  • Flash Point: 304.1°C
  • Refractive Index: 1.539

Carbamic acid,N-[(1E,5R)-5-[3-[(2E,4E)-2,5-dimethyl-1-oxo-2,4-nonadien-1-yl]-4-hydroxy-2-oxo-2H-pyran-6-yl]-1-hexen-1-yl]-,methyl ester Related Literature

Related Categories

88192-99-8 (Carbamic acid,N-[(1E,5R)-5-[3-[(2E,4E)-2,5-dimethyl-1-oxo-2,4-nonadien-1-yl]-4-hydroxy-2-oxo-2H-pyran-6-yl]-1-hexen-1-yl]-,methyl ester) Related Products

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