TPCN02127

Name 9??-hydroxy-11??,13-dihydroparthenolide-9-O-??-D-glucopyranoside
Molecular Formula C21H32O9
Molecular Weight 428.48
CAS Registry Number 2411538-53-7
SMILES CC1=CCCC2(C)OC2C2OC(=O)C(C)C2CC1OC1OC(CO)C(O)C(O)C1O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Asteriscus graveolens Aerial parts 0.000105% Natural Product Research 35, 2190-2198 (2021). 10.1080/14786419.2019.1666390
Properties
HBA 9 HBD 4
HeavyAtoms 30 AlogP -0.36
TPSA 138.21 RotatableBonds 3
FractionCSP3 0.86 Rings 4
AromaticRings 0 AliphaticRings 4