TPCN02700

Name 6,12,14-Trihydroxy-9r-(2-oxopropyl)abieta-5,8(14),12triene-7,11-dione
Molecular Formula C23H30O6
Molecular Weight 402.49
CAS Registry Number 868241-64-9
SMILES CC(=O)CC12C(=O)C(O)=C(C(C)C)C(O)=C1C(=O)C(O)=C1C(C)(C)CCCC12C
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Coleus grandidentatus Aerial parts 0.000370% J Nat Prod 68, 1408-1411 (2005). 10.1021/np0580457
Properties
HBA 6 HBD 3
HeavyAtoms 29 AlogP 4.43
TPSA 111.90 RotatableBonds 3
FractionCSP3 0.61 Rings 3
AromaticRings 0 AliphaticRings 3