Cas no 157878-07-4 (2(5H)-Furanone,4-[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-[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
157878-07-4 structure
Product Name:2(5H)-Furanone,4-[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:157878-07-4
MF:C20H30O5
MW:350.449206829071
CID:223670
Update Time:2024-03-01

2(5H)-Furanone,4-[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-[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-[2-[3,4,4a,5,6,7,8,8a-octahydro-4,7-dihydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-1-naphthalenyl]ethyl]-,[4S-(4a,4aa,5b,7a,8ab)]-
    • Amoenolide A
    • 2(5H)-Furanone, 4-[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/C20H30O5/c1-12-6-16(23)18-19(2,11-21)8-14(22)9-20(18,3)15(12)5-4-13-7-17(24)25-10-13/h7,14,16,18,21-23H,4-6,8-11H2,1-3H3/t14-,16-,18-,19+,20+/m0/s1
    • InChI Key： RTLIZBZNDDICQI-WRYWSJOASA-N
    • SMILES： O1CC(CCC2[C@]3(C)[C@]([H])([C@](CO)(C)C[C@H](O)C3)[C@@H](O)CC=2C)=CC1=O

Computed Properties

  • Exact Mass: 350.2094

Experimental Properties

  • Density: 1.189±0.06 g/cm3(Predicted)
  • Boiling Point: 555.3±50.0 °C(Predicted)
  • PSA: 86.99
  • pka: 14.45±0.70(Predicted)

2(5H)-Furanone,4-[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]- Related Literature

Related Categories

157878-07-4 (2(5H)-Furanone,4-[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]-) Related Products

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