TPCN02001

Name 3-hydroxysolavetivone-beta-D-glucoside A
Molecular Formula C21H32O7
Molecular Weight 396.48
CAS Registry Number 62574-25-8
SMILES C=C(C)C1CCC2(C1)C(C)=CC(=O)C(OC1OC(CO)C(O)C(O)C1O)C2C
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Solanaceae Nicotiana tabacum Leaves 0.000020% J Asian Nat Prod Res 12(3): 252-256.(2010) 10.1080/10286020903550947
Properties
HBA 7 HBD 4
HeavyAtoms 28 AlogP 0.70
TPSA 116.45 RotatableBonds 4
FractionCSP3 0.76 Rings 3
AromaticRings 0 AliphaticRings 3