1(10)-Aristolen-2-one

  • Identifiers

    CAS mumber
    28398-06-3

    Molecular formula
    C15H22O

    SMILES
    C[C@@H]1CC(=O)C=C2[C@]1([C@H]3[C@H](C3(C)C)CC2)C

  • Properties

    XLogP3-AA
    3.3 Well soluble in BB, DEP, MMB

    Molecular weight
    218.33 g/mol

  • Synonyms

    • 1(10)-Aristolen-2-one
    • 28398-06-3
    • (1aR,7R,7aR,7bS)-1,1,7,7a-tetramethyl-1a,2,3,6,7,7b-hexahydrocyclopropa[a]naphthalen-5-one
    • (1aR,7R,7aR,7bS)-1,1,7,7a-tetramethyl-1a,2,3,6,7,7b-hexahydrocyclopropa(a)naphthalen-5-one
    • CHEMBL2333552
    • CHEBI:228337
    • HY-N8422
    • AKOS040760857
    • FS-6886
    • DA-69342
    • E88921
    • (1aR,7R,7aR,7bS)-1,1,7,7a-tetramethyl-1aH,2H,3H,6H,7H,7bH-cyclopropa[a]naphthalen-5-one
1 3

Botanical

Name CAS Botanical Proportion
Spikenard 2 8022-22-8 Nardostachys jatamansi (Roxb.) DC., fam. Valerianaceae 0.01%
Calamus (China) 1a leaf 8015-79-0 Acorus calamus L., fam. Araceae 6.57%