Cas no 160669-33-0 (2(5H)-Furanone,4-[(1R)-1-hydroxy-2-[(4S,4aR,5S,7R,8aS)-3,4,4a,5,6,7,8,8a-octahydro-4,7-dihydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-1-naphthalenyl]ethyl]-)

2(5H)-Furanone,4-[(1R)-1-hydroxy-2-[(4S,4aR,5S,7R,8aS)-3,4,4a,5,6,7,8,8a-octahydro-4,7-dihydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-1-naphthalenyl]ethyl]- structure
160669-33-0 structure
Product Name:2(5H)-Furanone,4-[(1R)-1-hydroxy-2-[(4S,4aR,5S,7R,8aS)-3,4,4a,5,6,7,8,8a-octahydro-4,7-dihydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-1-naphthalenyl]ethyl]-
CAS No:160669-33-0
MF:C20H30O6
MW:366.448606967926
CID:207025
Update Time:2024-03-01

2(5H)-Furanone,4-[(1R)-1-hydroxy-2-[(4S,4aR,5S,7R,8aS)-3,4,4a,5,6,7,8,8a-octahydro-4,7-dihydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-1-naphthalenyl]ethyl]- Chemical and Physical Properties

Names and Identifiers

    • 2(5H)-Furanone,4-[(1R)-1-hydroxy-2-[(4S,4aR,5S,7R,8aS)-3,4,4a,5,6,7,8,8a-octahydro-4,7-dihydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-1-naphthalenyl]ethyl]-
    • 2(5H)-Furanone,4-[1-hydroxy-2-[3,4,4a,5,6,7,8,8a-octahydro-4,7-dihydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-1-naphthalenyl]ethyl]-,[4S-[1(S*),4a,4aa,5b,7a,8ab]]-
    • Amoenolide D
    • 2(5H)-Furanone, 4-[(1R)-1-hydroxy-2-[(4S,4aR,5S,7R,8aS)-3,4,4a,5,6,7,8,8a-octahydro-4,7-dihydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-1-naphthalenyl]ethyl]-
    • Inchi: 1S/C20H30O6/c1-11-4-16(24)18-19(2,10-21)7-13(22)8-20(18,3)14(11)6-15(23)12-5-17(25)26-9-12/h5,13,15-16,18,21-24H,4,6-10H2,1-3H3/t13-,15+,16-,18-,19+,20+/m0/s1
    • InChI Key: GHROEVMKDCVSOK-IKSQAYNDSA-N
    • SMILES: O1CC([C@H](O)CC2[C@]3(C)[C@]([H])([C@](CO)(C)C[C@H](O)C3)[C@@H](O)CC=2C)=CC1=O

Computed Properties

  • Exact Mass: 366.2043

Experimental Properties

  • Density: 1.263±0.06 g/cm3(Predicted)
  • Boiling Point: 601.6±55.0 °C(Predicted)
  • PSA: 107.22
  • pka: 14.16±0.20(Predicted)
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