Costunolide

  • Identifiers

    CAS number
    553-21-9

    Molecular formula
    C15H20O2

    SMILES
    C/C/1=C\CC/C(=C/[C@@H]2[C@@H](CC1)C(=C)C(=O)O2)/C

  • Odor profile

    spicy 57.12%
    herbal 55.17%
    mint 54.22%
    sweet 50.23%
    coumarinic 47.45%
    coconut 46.05%
    tobacco 41.95%
    hay 35.95%
    woody 35.23%
    celery 34.76%

    Scent© AI

  • Properties

    XLogP3-AA
    2.1 Well soluble in IAA, DEP, MMB

    Molecular weight
    232.32 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

  • Synonyms

    • Costunolide
    • 553-21-9
    • (+)-costunolide
    • Costunlide
    • Costus lactone
    • Costunolid
    • CHEBI:3900
    • (3aS,6E,10E,11aR)-6,10-dimethyl-3-methylene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2(3H)-one
    • CHEMBL86416
    • (3aS,6E,10E,11aR)-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one
    • (E,E)-6-alpha-Hydroxygermacra-1(10),4,11(13)-trien-12-oic acid gamma-lactone
    • (10S,1R)-3,7-dimethyl-11-methylene-13-oxabicyclo[8.3.0]trideca-2,6-dien-12-one
    • (E,E)-germacra-1(10),4,11(13)-trien-12-oic acid, 6-alpha-hydroxy-gamma-lactone
    • (3aS,6E,10E)-3-Methylene-6,10-dimethyl-2,3,3abeta,4,5,8,9,11aalpha-octahydrocyclodeca[b]furan-2-one
    • (3aS,6E,10E,11aR)-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2(3H)-one
    • CCRIS 6754
    • isocostunolide
    • C15H20O2
    • NSC 106404
    • melampolide
    • DTXSID001029520
    • NSC106404
    • NSC-106404
    • (10S,1R)-3,7-dimethyl-11-methylene-13-oxabicyclo(8.3.0)trideca-2,6-dien-12-one
    • (3aS,6E,10E)-3-methylene-6,10-dimethyl-2,3,3abeta,4,5,8,9,11aalpha-octahydrocyclodeca(b)furan-2-one
    • (3aS,6E,10E,11aR)-6,10-dimethyl-3-methylene-3a,4,5,8,9,11a-hexahydrocyclodeca(b)furan-2(3H)-one
    • (3aS,6E,10E,11aR)-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca(b)furan-2(3H)-one
    • (3aS,6E,10E,11aR)-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca(b)furan-2-one
    • MFCD00210262
    • Costunolide (Standard)
    • SCHEMBL92714
    • (+)-costunolide\, Costunolid
    • Costunolide, >=97% (HPLC)
    • HY-N0036R
    • Germacra-1(10),4,11(13)-trien-12-oic acid, 6-alpha-hydroxy-, gamma-lactone, (E,E)-
    • DTXCID301514754
    • HMS3269I17
    • HMS3413B19
    • HMS3677B19
    • (3AS,6E,10E,11AR)-6,10-DIMETHYL-3-METHYLENE-3,3A,4,5,8,9-HEXAHYDROCYCLODECA(B)FURAN-2(11AH)-ONE
    • Cyclodeca(b)furan-2(3H)-one, 3a,4,5,8,9,11a-hexahydro-6,10-dimethyl-3-methylene-, (3aS-(3aR*,6E,10E,11aS*))-
    • EX-A5462
    • HY-N0036
    • BDBM50411242
    • AKOS015840065
    • AKOS015969714
    • CS-1487
    • FC65612
    • NCGC00381718-02
    • (3aS,6E,10E,11aR)-3a,4,5,8,9,11a-Hexahydro-6,10-dimethyl-3-methylene-cyclodeca[b]furan-2(3H)-one
    • AC-28334
    • AS-17708
    • C2921
    • NS00066990
    • C09382
    • Q5175227
    • BRD-K26833429-001-01-0
    • BRD-K26833429-001-02-8
    • BRD-K26833429-001-03-6
    • (3aS,6E,10E,11aR)-6,10-dimethyl-3-methylene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one
    • 683-148-4
    • Cyclodeca(b)furan-2(3H)-one, 3a,4,5,8,9,11a-hexahydro-6,10-dimethyl-3-methylene-, (3aS-(3aR*,6E,10E,11aS*))-(9CI)
    • Cyclodeca[b]furan-2(3H)-one, 3a,4,5,8,9,11a-hexahydro-6,10-dimethyl-3-methylene-, (3aS,6E,10E,11aR)-
1 4

Botanical

Name CAS Botanical Proportion
Costus 8023-88-9 Saussurea lappa Clarke, fam. Zingiberaceae 1.0%