Cas no 500307-46-0 (2(3H)-Furanone,3-[2-[(1S,3S)-3-[(2Z)-2-[(1S,2'S,4S)-1-hydroxy-4,6,6-trimethylspiro[2,5-dioxabicyclo[2.2.2]octane-3,2'-[2H]pyran]-5'-ylidene]ethyl]-2,2-dimethyl-6-methylenecyclohexyl]ethylidene]dihydro-4-hydroxy-, (3E,4R)-)

2(3H)-Furanone,3-[2-[(1S,3S)-3-[(2Z)-2-[(1S,2'S,4S)-1-hydroxy-4,6,6-trimethylspiro[2,5-dioxabicyclo[2.2.2]octane-3,2'-[2H]pyran]-5'-ylidene]ethyl]-2,2-dimethyl-6-methylenecyclohexyl]ethylidene]dihydro-4-hydroxy-, (3E,4R)- structure
500307-46-0 structure
Product Name:2(3H)-Furanone,3-[2-[(1S,3S)-3-[(2Z)-2-[(1S,2'S,4S)-1-hydroxy-4,6,6-trimethylspiro[2,5-dioxabicyclo[2.2.2]octane-3,2'-[2H]pyran]-5'-ylidene]ethyl]-2,2-dimethyl-6-methylenecyclohexyl]ethylidene]dihydro-4-hydroxy-, (3E,4R)-
CAS No:500307-46-0
MF:C30H44O7
MW:516.666170120239
CID:1544932
Update Time:2024-08-23

2(3H)-Furanone,3-[2-[(1S,3S)-3-[(2Z)-2-[(1S,2'S,4S)-1-hydroxy-4,6,6-trimethylspiro[2,5-dioxabicyclo[2.2.2]octane-3,2'-[2H]pyran]-5'-ylidene]ethyl]-2,2-dimethyl-6-methylenecyclohexyl]ethylidene]dihydro-4-hydroxy-, (3E,4R)- Chemical and Physical Properties

Names and Identifiers

    • 2(3H)-Furanone,3-[2-[(1S,3S)-3-[(2Z)-2-[(1S,2'S,4S)-1-hydroxy-4,6,6-trimethylspiro[2,5-dioxabicyclo[2.2.2]octane-3,2'-[2H]pyran]-5'-ylidene]ethyl]-2,2-dimethyl-6-methylenecyclohexyl]ethylidene]dihydro-4-hydroxy-, (3E,4R)-
    • (+)-Saponaceolide F
    • Saponaceolide F
    • 2(3H)-Furanone, 3-[2-[(1S,3S)-2,2-dimethyl-6-methylene-3-[(2Z)-2-[(1S,2'S,4S)-tetrahydro-1-hydroxy-4,6,6-trimethylspiro[2,5-dioxabicyclo[2.2.2]octane-3,2'-[2H]pyran]-5'-ylidene]ethyl]cyclohexyl]ethylidene]dihydro-4-hydroxy-, (3E,4R)-
    • Inchi： 1S/C30H44O7/c1-19-7-9-21(26(2,3)23(19)12-11-22-24(31)18-34-25(22)32)10-8-20-13-14-30(35-17-20)28(6)15-16-29(33,37-30)27(4,5)36-28/h8,11,21,23-24,31,33H,1,7,9-10,12-18H2,2-6H3/b20-8-,22-11-
    • InChI Key： VNSBDFFVDBCTKZ-OFBFIYGQSA-N
    • SMILES： CC1(C2(OC3(C(CC2)(C)O1)OC/C(=C\CC1C(C)(C)C(C/C=C2\C(=O)OCC\2O)C(=C)CC1)/CC3)O)C

Computed Properties

  • Exact Mass: 514.29316
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 37
  • XLogP3: 5.059

Experimental Properties

  • Density: 1.21±0.1 g/cm3(Predicted)
  • Boiling Point: 660.3±55.0 °C(Predicted)
  • PSA: 94.45
  • pka: 12.36±0.20(Predicted)

2(3H)-Furanone,3-[2-[(1S,3S)-3-[(2Z)-2-[(1S,2'S,4S)-1-hydroxy-4,6,6-trimethylspiro[2,5-dioxabicyclo[2.2.2]octane-3,2'-[2H]pyran]-5'-ylidene]ethyl]-2,2-dimethyl-6-methylenecyclohexyl]ethylidene]dihydro-4-hydroxy-, (3E,4R)- Related Literature

Related Categories

500307-46-0 (2(3H)-Furanone,3-[2-[(1S,3S)-3-[(2Z)-2-[(1S,2'S,4S)-1-hydroxy-4,6,6-trimethylspiro[2,5-dioxabicyclo[2.2.2]octane-3,2'-[2H]pyran]-5'-ylidene]ethyl]-2,2-dimethyl-6-methylenecyclohexyl]ethylidene]dihydro-4-hydroxy-, (3E,4R)-) Related Products

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