TPCN03188
![[object Object]](../../static/browser_molecular_png/TPCN03188.png)
| Name | (?)-3??-Acetoxy-6??-hydroxy-15,16-dinorlabd-8(9)-ene-13-yne-7-one |
| Molecular Formula | C20H28O4 |
| Molecular Weight | 332.44 |
| CAS Registry Number | 1562426-47-4 |
| SMILES | C#CCCC1=C(C)C(=O)C(O)C2C1(C)CCC(OC(C)=O)C2(C)C |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Lamiaceae | Leonurus japonicus | Whole plants | 0.000030% | Molecules 18, 13904-13909 (2013). | 10.3390/molecules181113904 |
Properties
| HBA | 4 | HBD | 1 |
| HeavyAtoms | 24 | AlogP | 3.03 |
| TPSA | 63.60 | RotatableBonds | 3 |
| FractionCSP3 | 0.70 | Rings | 2 |
| AromaticRings | 0 | AliphaticRings | 2 |