TPCN02217

Name Kaur-16-en-15-one, 7,12,14,20-tetrahydroxy-, (7??,12??,14R)-
Molecular Formula C20H30O5
Molecular Weight 350.46
CAS Registry Number 675606-08-3
SMILES C=C1C(=O)C23C(O)CC4C(C)(C)CCCC4(CO)C2CC(O)C1C3O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Isodon excisus Aerial parts 0.006867% J Nat Prod 67, 373-376 (2004). 10.1021/np030357r
Properties
HBA 5 HBD 4
HeavyAtoms 25 AlogP 1.04
TPSA 97.99 RotatableBonds 1
FractionCSP3 0.85 Rings 4
AromaticRings 0 AliphaticRings 4