TPCN00838

Name 6alpha, 7alpha, 10alpha-trihydroxyisoducane;6,7,10-trihydoxyisodaucane
Molecular Formula C15H28O3
Molecular Weight 256.39
CAS Registry Number 260968-11-4
SMILES CC(C)C1CCC2(C)C(O)CCC(C)(O)C(O)C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Homalomena occulta Subterraneous stems 0.046429% Nat Prod Res 23(14): 1279-1283.(2009) 10.1080/14786410802187817
Schisandraceae Illicium burmanicum Barks 0.000362% Fitoterapia 92: 194-199.(2014) 10.1016/j.fitote.2013.11.001
Properties
HBA 3 HBD 3
HeavyAtoms 18 AlogP 1.94
TPSA 60.69 RotatableBonds 1
FractionCSP3 1.00 Rings 2
AromaticRings 0 AliphaticRings 2