TPCN03024

Name Kaur-16-en-15-one, 18-(acetyloxy)-1,7,14-trihydroxy-, (1??,4??,7??,14R)-
Molecular Formula C22H32O6
Molecular Weight 392.49
CAS Registry Number 194026-50-1
SMILES C=C1C(=O)C23C(O)CC4C(C)(COC(C)=O)CCC(O)C4(C)C2CCC1C3O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Isodon excisus Aerial parts 0.000100% J Nat Prod 67, 373-376 (2004). 10.1021/np030357r
Properties
HBA 6 HBD 3
HeavyAtoms 28 AlogP 1.61
TPSA 104.06 RotatableBonds 2
FractionCSP3 0.82 Rings 4
AromaticRings 0 AliphaticRings 4