TPCN01705

Name (7R)-3,4-Dehydrohinesolone-11-O-??-D-glucopyranoside
Molecular Formula C21H32O7
Molecular Weight 396.48
CAS Registry Number 1932660-07-5
SMILES CC1=CC(=O)C=C(C)C12CCC(C(C)(C)OC1OC(CO)C(O)C(O)C1O)C2
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Atractylodes lancea Subterraneous stems 0.000180% J Nat Prod 79(6): 1567-1575.(2016) 10.1021/acs.jnatprod.6b00066
Properties
HBA 7 HBD 4
HeavyAtoms 28 AlogP 0.84
TPSA 116.45 RotatableBonds 4
FractionCSP3 0.76 Rings 3
AromaticRings 0 AliphaticRings 3