TPCN02211

Name Helikaurolide C
Molecular Formula C40H52O8
Molecular Weight 660.85
CAS Registry Number 1809532-70-4
SMILES C=C1C(=O)OC2C3OC(C)(C=CC(=O)C3CCC3=CC45CCC6C(C)(C(=O)O)CCCC6(C)C4CCC3C5)CC(OC(=O)C(C)=CC)C12
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Helianthus annuus Leaves 0.007152% Org Lett 17, 4730-4733 (2015). 10.1021/acs.orglett.5b02221
Properties
HBA 8 HBD 1
HeavyAtoms 48 AlogP 7.08
TPSA 116.20 RotatableBonds 6
FractionCSP3 0.70 Rings 7
AromaticRings 0 AliphaticRings 7