Cas no 155112-68-8 ([(1R,2S,7R,8Ar)-7-hydroxy-1,8a-dimethyl-6-oxo-7-(3-oxoprop-1-en-2-yl)-2,8-dihydro-1H-naphthalen-2-yl] (2E,4E,6S)-6-methylocta-2,4-dienoate)

[(1R,2S,7R,8Ar)-7-hydroxy-1,8a-dimethyl-6-oxo-7-(3-oxoprop-1-en-2-yl)-2,8-dihydro-1H-naphthalen-2-yl] (2E,4E,6S)-6-methylocta-2,4-dienoate structure
155112-68-8 structure
Product Name:[(1R,2S,7R,8Ar)-7-hydroxy-1,8a-dimethyl-6-oxo-7-(3-oxoprop-1-en-2-yl)-2,8-dihydro-1H-naphthalen-2-yl] (2E,4E,6S)-6-methylocta-2,4-dienoate
CAS No:155112-68-8
MF:C24H30O5
MW:398.492007732391
CID:208153
Update Time:2024-03-01

[(1R,2S,7R,8Ar)-7-hydroxy-1,8a-dimethyl-6-oxo-7-(3-oxoprop-1-en-2-yl)-2,8-dihydro-1H-naphthalen-2-yl] (2E,4E,6S)-6-methylocta-2,4-dienoate Chemical and Physical Properties

Names and Identifiers

    • 2,4-Octadienoic acid,6-methyl-,(1R,2S,7R,8aR)-7-(1-formylethenyl)-1,2,6,7,8,8a-hexahydro-7-hydroxy-1,8a-dimethyl-6-oxo-2-naphthalenylester, (2E,4E,6S)-
    • 2,4-Octadienoic acid,6-methyl-,(1R,2S,7R,8aR)-7-(1-formylethenyl)-1,2,6,7,8,8a-hexahydro-7-hydroxy-1,8a-dimethyl-6-oxo-2-naph
    • 2,4-Octadienoicacid, 6-methyl-,7-(1-formylethenyl)-1,2,6,7,8,8a-hexahydro-7-hydroxy-1,8a-dimethyl-6-oxo-2-naphthalenylester, [1R-[1a,2a(2E,4E,6S*),7a,8aa]]-
    • Bipolal
    • KM 01
    • KM 01 (plant growth regulator)
    • [(1R,2S,7R,8Ar)-7-hydroxy-1,8a-dimethyl-6-oxo-7-(3-oxoprop-1-en-2-yl)-2,8-dihydro-1H-naphthalen-2-yl
    • [(1R,2S,7R,8Ar)-7-hydroxy-1,8a-dimethyl-6-oxo-7-(3-oxoprop-1-en-2-yl)-2,8-dihydro-1H-naphthalen-2-yl] (2E,4E,6S)-6-methylocta-2,4-dienoate
    • Inchi： 1S/C24H30O5/c1-6-16(2)9-7-8-10-22(27)29-20-12-11-19-13-21(26)24(28,17(3)14-25)15-23(19,5)18(20)4/h7-14,16,18,20,28H,3,6,15H2,1-2,4-5H3/b9-7+,10-8+/t16-,18-,20-,23+,24+/m0/s1
    • InChI Key： GIUVFWDLNFDKHT-PKSNHMFESA-N
    • SMILES： O(C(/C=C/C=C/[C@@H](C)CC)=O)[C@H]1C=CC2=CC([C@](C(=C)C=O)(C[C@]2(C)[C@H]1C)O)=O

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 29
  • Rotatable Bond Count: 8
  • Complexity: 815
  • Topological Polar Surface Area: 80.7

[(1R,2S,7R,8Ar)-7-hydroxy-1,8a-dimethyl-6-oxo-7-(3-oxoprop-1-en-2-yl)-2,8-dihydro-1H-naphthalen-2-yl] (2E,4E,6S)-6-methylocta-2,4-dienoate Related Literature

Related Categories

155112-68-8 ([(1R,2S,7R,8Ar)-7-hydroxy-1,8a-dimethyl-6-oxo-7-(3-oxoprop-1-en-2-yl)-2,8-dihydro-1H-naphthalen-2-yl] (2E,4E,6S)-6-methylocta-2,4-dienoate) Related Products

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