TPCN01722

Name Chloranthalactone E 8-O-??-D-glucopyranoside
Molecular Formula C21H28O9
Molecular Weight 424.45
CAS Registry Number 882513-45-3
SMILES C=C1C2CC2C2(C)C1CC1=C(C)C(=O)OC1(OC1OC(CO)C(O)C(O)C1O)C2O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Chloranthaceae Sarcandra glabra Whole plants 0.000167% J Nat Prod 69(4): 616-620.(2006) 10.1021/np050480d
Properties
HBA 9 HBD 5
HeavyAtoms 30 AlogP -1.03
TPSA 145.91 RotatableBonds 3
FractionCSP3 0.76 Rings 5
AromaticRings 0 AliphaticRings 5