TPCN00046

Name 5-(2,3-dihydroxy-3-methylbutyl)-4-methylfuran-2(5H)-one
Molecular Formula C10H16O4
Molecular Weight 200.23
CAS Registry Number 2059941-57-8
SMILES CC1=CC(=O)OC1CC(O)C(C)(C)O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Lauraceae Cinnamomum inunctum Fruits 0.023127% Chem Pharm Bull (Tokyo), 2015, 63, 833-836. 10.1248/cpb.c15-00368
Properties
HBA 4 HBD 2
HeavyAtoms 14 AlogP 0.38
TPSA 66.76 RotatableBonds 3
FractionCSP3 0.70 Rings 1
AromaticRings 0 AliphaticRings 1