Cas no 1187951-06-9 (2H-Naphtho[2,1-c]pyran-7-carboxylicacid, 2-(3-furanyl)dodecahydro-6a,9-dihydroxy-10b-methyl-4,6-dioxo-,(2S,4aS,6aR,7R,9R,10aS,10bS)-)

2H-Naphtho[2,1-c]pyran-7-carboxylicacid, 2-(3-furanyl)dodecahydro-6a,9-dihydroxy-10b-methyl-4,6-dioxo-,(2S,4aS,6aR,7R,9R,10aS,10bS)- structure
1187951-06-9 structure
Product Name:2H-Naphtho[2,1-c]pyran-7-carboxylicacid, 2-(3-furanyl)dodecahydro-6a,9-dihydroxy-10b-methyl-4,6-dioxo-,(2S,4aS,6aR,7R,9R,10aS,10bS)-
CAS No:1187951-06-9
MF:C19H22O8
MW:378.373186588287
CID:97704
PubChem ID:44130234
Update Time:2025-04-18

2H-Naphtho[2,1-c]pyran-7-carboxylicacid, 2-(3-furanyl)dodecahydro-6a,9-dihydroxy-10b-methyl-4,6-dioxo-,(2S,4aS,6aR,7R,9R,10aS,10bS)- Chemical and Physical Properties

Names and Identifiers

    • 2H-Naphtho[2,1-c]pyran-7-carboxylicacid, 2-(3-furanyl)dodecahydro-6a,9-dihydroxy-10b-methyl-4,6-dioxo-,(2S,4aS,6aR,7R,9R,10aS,10bS)-
    • (2S,4aS,6aR,7R,9R,10aS,10bS)-2-(3-Furyl)-6a,9-dihydroxy-10b-methy l-4,6-dioxododecahydro-2H-benzo[f]isochromene-7-carboxylic acid
    • 2H-Naphtho[2,1-c]pyran-7-carboxylicacid, 2-(3-furanyl)dodecahydro-6a,9-dihydroxy-10b-methyl-4,...
    • 2H-Naphtho[2,1-c]pyran-7-carboxylicacid, 2-(3-furanyl)dodecahydro-6a,9-dihydroxy-10b-methyl-4,6-dioxo-,(2S,4aS,6aR,7R,9R,10aS
    • Diosbulbin J
    • di-O-propionyl-1,4,3,6-dianhydro-D-glucitol
    • diosbulbin I
    • [ "" ]
    • AKOS032961681
    • 1187951-06-9
    • FS-10201
    • (2S,4aS,6aR,7R,9R,10aS,10bS)-2-(3-Furanyl)dodecahydro-6a,9-dihydroxy-10b-methyl-4,6-dioxo-2H-naphtho[2,1-c]pyran-7-carboxylic acid
    • (2S,4aS,6aR,7R,9R,10aS,10bS)-2-(furan-3-yl)-6a,9-dihydroxy-10b-methyl-4,6-dioxo-2,4a,5,7,8,9,10,10a-octahydro-1H-benzo[f]isochromene-7-carboxylic acid
    • DTXSID301102620
    • (2S,4aS,6aR,7R,9R,10aS,10bS)-2-(furan-3-yl)-6a,9-dihydroxy-10b-methyl-4,6-dioxo-octahydro-1H-naphtho[2,1-c]pyran-7-carboxylic acid
    • Inchi： 1S/C19H22O8/c1-18-7-13(9-2-3-26-8-9)27-17(24)12(18)6-15(21)19(25)11(16(22)23)4-10(20)5-14(18)19/h2-3,8,10-14,20,25H,4-7H2,1H3,(H,22,23)/t10-,11-,12+,13-,14-,18+,19-/m0/s1
    • InChI Key： VFBSFVHKKKXNHM-JFQAYLLPSA-N
    • SMILES： O[C@]12C(C[C@@H]3C(=O)O[C@H](C4=COC=C4)C[C@@]3(C)[C@@H]1C[C@H](C[C@H]2C(=O)O)O)=O

Computed Properties

  • Exact Mass: 378.13100
  • Monoisotopic Mass: 378.131
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 27
  • Rotatable Bond Count: 2
  • Complexity: 677
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 7
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 134A^2
  • XLogP3: 0.4

Experimental Properties

  • Color/Form: Powder
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 670.3±55.0 °C at 760 mmHg
  • Flash Point: 359.2±31.5 °C
  • PSA: 134.27000
  • LogP: 1.06570
  • Vapor Pressure: 0.0±2.2 mmHg at 25°C

2H-Naphtho[2,1-c]pyran-7-carboxylicacid, 2-(3-furanyl)dodecahydro-6a,9-dihydroxy-10b-methyl-4,6-dioxo-,(2S,4aS,6aR,7R,9R,10aS,10bS)- Security Information

2H-Naphtho[2,1-c]pyran-7-carboxylicacid, 2-(3-furanyl)dodecahydro-6a,9-dihydroxy-10b-methyl-4,6-dioxo-,(2S,4aS,6aR,7R,9R,10aS,10bS)- Pricemore >>

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2H-Naphtho[2,1-c]pyran-7-carboxylicacid, 2-(3-furanyl)dodecahydro-6a,9-dihydroxy-10b-methyl-4,6-dioxo-,(2S,4aS,6aR,7R,9R,10aS,10bS)- Related Literature

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