Cas no 141340-34-3 (Erythromycin,9,10-didehydro-N-demethyl-9-deoxo-11,12-dideoxy-9,12-epoxy-11-oxo- (9CI))

Erythromycin,9,10-didehydro-N-demethyl-9-deoxo-11,12-dideoxy-9,12-epoxy-11-oxo- (9CI) structure
141340-34-3 structure
Product Name:Erythromycin,9,10-didehydro-N-demethyl-9-deoxo-11,12-dideoxy-9,12-epoxy-11-oxo- (9CI)
CAS No:141340-34-3
MF:C36H61NO12
MW:699.869052648544
CID:149663
PubChem ID:84032
Update Time:2025-04-19

Erythromycin,9,10-didehydro-N-demethyl-9-deoxo-11,12-dideoxy-9,12-epoxy-11-oxo- (9CI) Chemical and Physical Properties

Names and Identifiers

    • Erythromycin,9,10-didehydro-N-demethyl-9-deoxo-11,12-dideoxy-9,12-epoxy-11-oxo- (9CI)
    • 11-ethyl-4-hydroxy-7-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-5-[3-hydroxy-6-methyl-4-(methylamino)oxan-2-yl]oxy-2,4,6,8,12,14-hexamethyl-10,15-dioxabicyclo[10.2.1]pentadec-1(14)-ene-9,13-dione
    • 2-ethyl-9-hydroxy-6-[(5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy]-8-{[3-hydroxy-6-methyl-4-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-1,5,7,9,11,13-hexamethyl-3,15-dioxabicyclo[10.2.1]pentadec-12-ene-4,14-dione (non-preferred name)
    • Erythromycin 9,10-didehydro-N-demethyl-9-deoxo-11,12-dideoxy-9,12-epoxy-11-oxo-
    • N-Demethyl-9-deoxo-11,12-dideoxy-9,12-epoxy-11-oxo-9,10-didehydroerythromycin
    • Sporeamicin C
    • 2-ethyl-9-hydroxy-6-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-8-[3-hydroxy-6-methyl-4-(methylamino)oxan-2-yl]oxy-1,5,7,9,11,13-hexamethyl-3,15-dioxabicyclo[10.2.1]pentadec-12-ene-4,14-dione
    • 141340-34-3
    • Inchi： 1S/C36H61NO12/c1-13-24-36(10)29(39)19(4)27(49-36)17(2)15-34(8,42)31(48-33-26(38)23(37-11)14-18(3)44-33)20(5)28(21(6)32(41)46-24)47-25-16-35(9,43-12)30(40)22(7)45-25/h17-18,20-26,28,30-31,33,37-38,40,42H,13-16H2,1-12H3
    • InChI Key： PLXBYEZLPVFWDI-UHFFFAOYSA-N
    • SMILES： O(C1C(C(CC(C)O1)NC)O)C1C(C)(CC(C)C2=C(C)C(C(C)(C(CC)OC(C(C)C(C1C)OC1CC(C)(C(C(C)O1)O)OC)=O)O2)=O)O

Computed Properties

  • Exact Mass: 699.419
  • Monoisotopic Mass: 699.419
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 13
  • Heavy Atom Count: 49
  • Rotatable Bond Count: 7
  • Complexity: 1230
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 16
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 172A^2
  • XLogP3: 2.6

Experimental Properties

  • Density: 1.21
  • Boiling Point: 811.2°Cat760mmHg
  • Flash Point: 444.4°C
  • Refractive Index: 1.537

Erythromycin,9,10-didehydro-N-demethyl-9-deoxo-11,12-dideoxy-9,12-epoxy-11-oxo- (9CI) Related Literature

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