Cas no 56650-63-6 (6H-4,7-Methenofuro[3,2-c]oxacycloundecin-2,6(3H)-dione,11-[(acetyloxy)methyl]-8-ethoxy-3a,4,8,9,10,12a-hexahydro-3-methylene-,(3aS,4R,8R,11E,12aR)-)

6H-4,7-Methenofuro[3,2-c]oxacycloundecin-2,6(3H)-dione,11-[(acetyloxy)methyl]-8-ethoxy-3a,4,8,9,10,12a-hexahydro-3-methylene-,(3aS,4R,8R,11E,12aR)- structure
56650-63-6 structure
Product Name:6H-4,7-Methenofuro[3,2-c]oxacycloundecin-2,6(3H)-dione,11-[(acetyloxy)methyl]-8-ethoxy-3a,4,8,9,10,12a-hexahydro-3-methylene-,(3aS,4R,8R,11E,12aR)-
CAS No:56650-63-6
MF:C19H22O7
MW:362.373786449432
CID:376946
PubChem ID:5384115
Update Time:2025-04-19

6H-4,7-Methenofuro[3,2-c]oxacycloundecin-2,6(3H)-dione,11-[(acetyloxy)methyl]-8-ethoxy-3a,4,8,9,10,12a-hexahydro-3-methylene-,(3aS,4R,8R,11E,12aR)- Chemical and Physical Properties

Names and Identifiers

    • 6H-4,7-Methenofuro[3,2-c]oxacycloundecin-2,6(3H)-dione,11-[(acetyloxy)methyl]-8-ethoxy-3a,4,8,9,10,12a-hexahydro-3-methylene-,(3aS,4R,8R,11E,12aR)-
    • 6H-4,7-Methenofuro[3,2-c]oxacycloundecin-2,6(3H)-dione,11-[(acetyloxy)methyl]-8-ethoxy-3a,4,8,9,10,12a-hexahydro-3-methylene-
    • CINERENIN ACETATE
    • NSC306948
    • NSC-306948
    • 56650-63-6
    • DTXSID60419492
    • Inchi： 1S/C19H22O7/c1-4-23-14-6-5-12(9-24-11(3)20)7-15-17(10(2)18(21)25-15)16-8-13(14)19(22)26-16/h7-8,14-17H,2,4-6,9H2,1,3H3/b12-7+
    • InChI Key： IAHRRUNNPWEGOH-KPKJPENVSA-N
    • SMILES： O1C(C2=CC1C1C(=C)C(=O)OC1C=C(COC(C)=O)CCC2OCC)=O |t:14|

Computed Properties

  • Exact Mass: 362.136553
  • Monoisotopic Mass: 362.136553
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 5
  • Complexity: 703
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1
  • Topological Polar Surface Area: 88.1

Experimental Properties

  • Density: 1.27
  • Boiling Point: 602.8°Cat760mmHg
  • Flash Point: 265.3°C
  • Refractive Index: 1.546
  • PSA: 88.13000
  • LogP: 1.62440

6H-4,7-Methenofuro[3,2-c]oxacycloundecin-2,6(3H)-dione,11-[(acetyloxy)methyl]-8-ethoxy-3a,4,8,9,10,12a-hexahydro-3-methylene-,(3aS,4R,8R,11E,12aR)- Related Literature

56650-63-6 (6H-4,7-Methenofuro[3,2-c]oxacycloundecin-2,6(3H)-dione,11-[(acetyloxy)methyl]-8-ethoxy-3a,4,8,9,10,12a-hexahydro-3-methylene-,(3aS,4R,8R,11E,12aR)-) Related Products

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