Cas no 110383-37-4 (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-[(2S)-2-methyl-1-oxobutyl]-,(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-[(2S)-2-methyl-1-oxobutyl]-,(6R)- (9CI) structure
110383-37-4 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-[(2S)-2-methyl-1-oxobutyl]-,(6R)- (9CI)
CAS No:110383-37-4
MF:C27H40O5
MW:444.60350894928
CID:201332
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-[(2S)-2-methyl-1-oxobutyl]-,(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-[(2S)-2-methyl-1-oxobutyl]-,(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-oxobutyl)-,[1S-[1a[S*(R*)],2a,5b]]-
    • Chinesin I
    • Inchi: 1S/C27H40O5/c1-9-17(6)22(28)21-23(29)19(14-20-18(16(4)5)11-13-27(20,8)32)24(30)26(7,25(21)31)12-10-15(2)3/h10,17-18,20,29-30,32H,4,9,11-14H2,1-3,5-8H3/t17-,18-,20-,26+,27+/m0/s1
    • InChI Key: SEHZNEFMBPPMQP-WRXUSKHFSA-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@@H](C)CC

Computed Properties

  • Exact Mass: 272.08309

Experimental Properties

  • PSA: 52.54
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