TPCN01822

Name Episamarcandin
Molecular Formula C24H32O5
Molecular Weight 400.52
CAS Registry Number 1694677-90-1
SMILES CC1(O)CCC2C(C)(C)C(O)CCC2(C)C1COc1ccc2ccc(=O)oc2c1
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Ferula sinkiangensis Seeds 0.000095% Fitoterapia 103: 222-226.(2013) 10.1016/j.fitote.2015.03.022
Properties
HBA 5 HBD 2
HeavyAtoms 29 AlogP 4.14
TPSA 79.90 RotatableBonds 3
FractionCSP3 0.63 Rings 4
AromaticRings 2 AliphaticRings 2