TPCN03135

Name 1a,Lla,15b-triacetyl-6b,7b-dihydroxyl-7a,20-epoxy-kaur-16-en
Molecular Formula C26H36O9
Molecular Weight 492.57
CAS Registry Number 80138-69-8
SMILES C=C1C2CC(OC(C)=O)C3C45COC(O)(C(O)C4C(C)(C)CCC5OC(C)=O)C3(C2)C1OC(C)=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Isodon henryi Aerial parts 0.000050% Nat Prod Res, 1-7 (2019). 10.1080/14786419.2019.1675067
Properties
HBA 9 HBD 2
HeavyAtoms 35 AlogP 1.88
TPSA 128.59 RotatableBonds 3
FractionCSP3 0.81 Rings 6
AromaticRings 0 AliphaticRings 6