TPCN05814

Name Lycernuic ketone C
Molecular Formula C30H48O4
Molecular Weight 472.71
CAS Registry Number 53800-21-8
SMILES CC12CCC3C(C)(CO)C(O)CCC3(C)C1CCC1C(=CC(=O)C3C(C)(C)C(O)CCC13C)C2
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Lycopodiaceae Lycopodium japonicum Whole plants 0.000208% J Asian Nat Prod Res. 2017 Mar;19(3):299-303. 10.1080/10286020.2016.1208182.
Properties
HBA 4 HBD 3
HeavyAtoms 34 AlogP 5.29
TPSA 77.76 RotatableBonds 1
FractionCSP3 0.90 Rings 5
AromaticRings 0 AliphaticRings 5