TPCN05991

Name Leucasin
Molecular Formula C42H70O12
Molecular Weight 767.01
CAS Registry Number 140231-39-6
SMILES C=C(C)C1CCC2(C)CCC3(C)C(CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C12
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Leucas nutans Whole plants 0.003947% Phytochemistry. 1994 Jan;30(12):4181-3 10.1016/0031-9422(91)83497-9
Properties
HBA 12 HBD 8
HeavyAtoms 54 AlogP 2.64
TPSA 198.76 RotatableBonds 7
FractionCSP3 0.95 Rings 7
AromaticRings 0 AliphaticRings 7