TPCN01199

Name Pallidones B
Molecular Formula C25H32O5
Molecular Weight 412.53
CAS Registry Number 264622-01-7
SMILES COc1ccc2c3c(c(=O)oc2c1)C(C)(CCC=C(C)CC(=O)CC(C)C)C(C)O3
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Apiaceae Ferula pallida Roots 0.001375% J Nat Prod 63(4): 436-440.(2000) 10.1021/np990262i
Properties
HBA 5 HBD 0
HeavyAtoms 30 AlogP 5.57
TPSA 65.74 RotatableBonds 8
FractionCSP3 0.52 Rings 3
AromaticRings 2 AliphaticRings 1