TPCN01032

Name Carmanin
Molecular Formula C20H28O8
Molecular Weight 396.44
CAS Registry Number 104407-37-6
SMILES C=C(CO)C(=O)OC1CC2(C)C(O)CCC(C=O)C2C(O)C1C(=C)C(=O)OC
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Onopordum illyricum Aerial parts 0.003557% Fitoterapia 116: 61-65.(2017) 10.1016/j.fitote.2016.11.006
Properties
HBA 8 HBD 3
HeavyAtoms 28 AlogP 0.15
TPSA 130.36 RotatableBonds 6
FractionCSP3 0.65 Rings 2
AromaticRings 0 AliphaticRings 2