TPCN00107

Name Thymoquinol 2-O-b-glucopyranoside
Molecular Formula C16H24O7
Molecular Weight 328.36
CAS Registry Number 95645-52-6
SMILES Cc1cc(O)c(C(C)C)cc1OC1OC(CO)C(O)C(O)C1O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Origanum syriacum Aerial parts 0.004500% Phytochemistry, 2001, 58, 1149-1152. 10.1016/s0031-9422(01)00386-7
Properties
HBA 7 HBD 5
HeavyAtoms 23 AlogP 0.00
TPSA 119.61 RotatableBonds 4
FractionCSP3 0.63 Rings 2
AromaticRings 1 AliphaticRings 1