TPCN00920
Name | 3beta,6beta,8alpha-triacetoxy-4beta,5alpha-epoxygermacr-1 (10) E-ene, 3beta,6beta,8alpha-triacetoxy-4beta,5alpha:1alpha,10beta-diepoxygermacrane |
Molecular Formula | C21H32O7 |
Molecular Weight | 396.48 |
CAS Registry Number | 678145-35-2 |
SMILES | CC(=O)OC1CC(C)=CCC(OC(C)=O)C2(C)OC2C(OC(C)=O)C1C(C)C |
Classify | Sesquiterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Asteraceae | Salvia roborowskii | Whole plants | 0.010000% | Planta Med 69(8): 782-784.(2003) | 10.1055/s-2003-42777 |
Properties
HBA | 7 | HBD | 0 |
HeavyAtoms | 28 | AlogP | 2.95 |
TPSA | 91.43 | RotatableBonds | 4 |
FractionCSP3 | 0.76 | Rings | 2 |
AromaticRings | 0 | AliphaticRings | 2 |