Cas no 110383-38-5 (2,4-Cyclohexadien-1-one,3,5-dihydroxy-4-[[(1S,2R,5R)-2-hydroxy-2-methyl-5-(1-methylethenyl)cyclopentyl]methyl]-6-methyl-6-(3-methyl-2-butenyl)-2-(2-methyl-1-oxopropyl)-,(6R)- (9CI))

2,4-Cyclohexadien-1-one,3,5-dihydroxy-4-[[(1S,2R,5R)-2-hydroxy-2-methyl-5-(1-methylethenyl)cyclopentyl]methyl]-6-methyl-6-(3-methyl-2-butenyl)-2-(2-methyl-1-oxopropyl)-,(6R)- (9CI) structure
110383-38-5 structure
Product Name:2,4-Cyclohexadien-1-one,3,5-dihydroxy-4-[[(1S,2R,5R)-2-hydroxy-2-methyl-5-(1-methylethenyl)cyclopentyl]methyl]-6-methyl-6-(3-methyl-2-butenyl)-2-(2-methyl-1-oxopropyl)-,(6R)- (9CI)
CAS No:110383-38-5
MF:C26H38O5
MW:430.57692861557
CID:217953
Update Time:2024-03-01

2,4-Cyclohexadien-1-one,3,5-dihydroxy-4-[[(1S,2R,5R)-2-hydroxy-2-methyl-5-(1-methylethenyl)cyclopentyl]methyl]-6-methyl-6-(3-methyl-2-butenyl)-2-(2-methyl-1-oxopropyl)-,(6R)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 2,4-Cyclohexadien-1-one,3,5-dihydroxy-4-[[(1S,2R,5R)-2-hydroxy-2-methyl-5-(1-methylethenyl)cyclopentyl]methyl]-6-methyl-6-(3-methyl-2-butenyl)-2-(2-methyl-1-oxopropyl)-,(6R)- (9CI)
    • 2,4-Cyclohexadien-1-one,3,5-dihydroxy-4-[[(1S,2R,5R)-2-hydroxy-2-methyl-5-(1-methylethenyl)cyclopentyl]methyl]-6-methyl-6-(3-
    • 2,4-Cyclohexadien-1-one,3,5-dihydroxy-4-[[2-hydroxy-2-methyl-5-(1-methylethenyl)cyclopentyl]methyl]-6-methyl-6-(3-methyl-2-butenyl)-2-(2-methyl-1-oxopropyl)-,[1S-[1a(S*),2a,5b]]-
    • Chinesin II
    • 2,4-Cyclohexadien-1-one, 3,5-dihydroxy-4-[[(1S,2R,5R)-2-hydroxy-2-methyl-5-(1-methylethenyl)cyclopentyl]methyl]-6-methyl-6-(3-methyl-2-butenyl)-2-(2-methyl-1-oxopropyl)-, (6R)- (9CI)
    • Inchi： 1S/C26H38O5/c1-14(2)9-11-25(7)23(29)18(22(28)20(24(25)30)21(27)16(5)6)13-19-17(15(3)4)10-12-26(19,8)31/h9,16-17,19,28-29,31H,3,10-13H2,1-2,4-8H3/t17-,19-,25+,26+/m0/s1
    • InChI Key： QYPGFMLLGVPVHG-IPFQZCJUSA-N
    • SMILES： C1(=O)[C@](C)(C/C=C(/C)\C)C(O)=C(C[C@H]2[C@H](C(C)=C)CC[C@]2(O)C)C(O)=C1C(=O)C(C)C

Computed Properties

  • Exact Mass: 272.08309

Experimental Properties

  • Density: 1.126±0.06 g/cm3(Predicted)
  • Boiling Point: 615.2±55.0 °C(Predicted)
  • PSA: 52.54
  • pka: 4.50±1.00(Predicted)

2,4-Cyclohexadien-1-one,3,5-dihydroxy-4-[[(1S,2R,5R)-2-hydroxy-2-methyl-5-(1-methylethenyl)cyclopentyl]methyl]-6-methyl-6-(3-methyl-2-butenyl)-2-(2-methyl-1-oxopropyl)-,(6R)- (9CI) Related Literature

Related Categories

110383-38-5 (2,4-Cyclohexadien-1-one,3,5-dihydroxy-4-[[(1S,2R,5R)-2-hydroxy-2-methyl-5-(1-methylethenyl)cyclopentyl]methyl]-6-methyl-6-(3-methyl-2-butenyl)-2-(2-methyl-1-oxopropyl)-,(6R)- (9CI)) Related Products

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