TPCN03402

Name Kurzipene B
Molecular Formula C28H42O7
Molecular Weight 490.64
CAS Registry Number 2522595-99-7
SMILES C=CC(=C)CCC1(C)C(C)CC(OC(=O)CC(C)C)C23C(=CC(O)CC12)C(OC)OC3OC(C)=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Salicaceae Casearia kurzii Leaves 0.000107% None 10.1016/j.bioorg.2020.103741
Properties
HBA 7 HBD 1
HeavyAtoms 35 AlogP 4.70
TPSA 91.29 RotatableBonds 9
FractionCSP3 0.71 Rings 3
AromaticRings 0 AliphaticRings 3