Nepetalactone 3a

  • Identifiers

    CAS mumber
    17257-15-7

    Molecular formula
    C10H14O2

    SMILES
    C[C@H]1CC[C@H]2[C@H]1C(=O)OC=C2C

    Retention indicies (RI)

    • DB5: 1360.0

  • Properties

    XLogP3-AA
    1.9 Well soluble in DEP, MMB, TEC

    Molecular weight
    166.22 g/mol

  • Synonyms

    • trans-cis-Nepetalactone
    • Epinepetalactone
    • Isonepetalactone
    • 17257-15-7
    • trans,cis-Nepetalactone
    • E,Z-Nepetalactone
    • Nepetalactone trans-cis-form
    • (+)-trans,cis-Nepetalactone
    • (4As,7S,7aS)-Nepetalactone
    • Nepetalactone, (+)-(4aS,7S,7aS)-
    • UNII-VZ45G6PT5C
    • VZ45G6PT5C
    • (4aS,7S,7aS)-4,7-dimethyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[c]pyran-1-one
    • 4a.alpha.,7.alpha.,7a.beta.-Nepetalactone
    • (+)-(4aS,7S,7aS)-nepetalactone
    • Cyclopenta(c)pyran-1(4aH)-one, 5,6,7,7a-tetrahydro-4,7-dimethyl-, (4aS,7S,7aS)-
    • (4aS,7S,7aS)-4,7-dimethyl-5,6,7,7a-tetrahydrocyclopenta[c]pyran-1(4aH)-one
    • 4aalpha,7alpha,7abeta-Nepetalactone
    • CHEBI:7519
    • SCHEMBL13039924
    • DTXSID00169348
    • ZDKZHVNKFOXMND-ZQARSLAVSA-N
    • LMPR0102070014
    • C09792
    • Q27107520
    • (4aalpha,7alpha,7abeta)-5,6,7,7a-tetrahydro-4,7-dimethylcyclopenta[c]pyran-1(4aH)-one
1 3

Botanical

Name CAS Botanical Proportion
Nepeta persica (Iran) Nepeta persica Boiss, fam. Lamiaceae (Labiatae) 26.5%
Nepeta argolica (Greece) 1a chemotype 1 Nepeta argolica Bory & Chaub. ssp. argolica, fam. Lamiaceae (Labiatae) 1.93%
Nepeta argolica (Greece) 1b chemotype 2 Nepeta argolica Bory & Chaub. ssp. argolica, fam. Lamiaceae (Labiatae) 29.38%
Ridolfia segetum (Spain) 1a stem Ridolfia segetum (L.) Moris, fam. Apiaceae (Umbelliferae) 1.0%
Ridolfia segetum (Spain) 1b leaf Ridolfia segetum (L.) Moris, fam. Apiaceae (Umbelliferae) 0.05%
Ridolfia segetum (Spain) 1c flower Ridolfia segetum (L.) Moris, fam. Apiaceae (Umbelliferae) 0.35%