TPCN01772

Name 1??-O-??-D-gluco-pyranosyl-5??,6??H-eudesma-3-en-12, 6??-olide
Molecular Formula C21H32O8
Molecular Weight 412.48
CAS Registry Number 863767-56-0
SMILES CC1=CCC(OC2OC(CO)C(O)C(O)C2O)C2(C)CCC3C(C)C(=O)OC3C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Celastraceae Sonchus arvensis Whole plants 0.000128% Fitoterapia 81(5): 424-428.(2010) 10.1016/j.fitote.2009.12.001
Properties
HBA 8 HBD 4
HeavyAtoms 29 AlogP 0.12
TPSA 125.68 RotatableBonds 3
FractionCSP3 0.86 Rings 4
AromaticRings 0 AliphaticRings 4