Heraclenol

  • Identifiers

    CAS mumber
    31575-93-6

    Molecular formula
    C16H16O6

    SMILES
    CC(C)([C@@H](COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)O)O

  • Properties

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

    Molecular weight
    304.29 g/mol

  • Synonyms

    • Heraclenol
    • 31575-93-6
    • 9WSY53477L
    • UNII-9WSY53477L
    • NSC-306227
    • NSC 306227
    • MLS000574834
    • CHEMBL1173444
    • DTXSID60185468
    • HMS2209F04
    • HY-N4052
    • AKOS037515115
    • FS-9747
    • Heraclenol, >=95% (LC/MS-ELSD)
    • DA-53949
    • SMR000156207
    • CS-0024539
    • Q3785098
    • 9-[(2R)-2,3-dihydroxy-3-methyl-butoxy]furo[3,2-g]chromen-7-one
    • (R)-9-(2,3-Dihydroxy-3-methylbutoxy)-7H-furo[3,2-g]chromen-7-one
    • 7H-Furo(3,2-g)(1)benzopyran-7-one, 9-(2,3-dihydroxy-3-methylbutoxy)-, (R)-
1 3

Botanical

Name CAS Botanical Proportion
Parsley leaf (Germany), 1b (smooth leaf) 8000-68-8 Petroselinum crispum (Miller) A.W. Hill (P. sativum Hoffm.), fam. Apiaceae 3.1%
Parsley leaf (Germany), 1a (curly leaf) 8000-68-8 Petroselinum crispum (Miller) A.W. Hill (P. sativum Hoffm.), fam. Apiaceae 0.01%