TPCN01469
![[object Object]](../../static/browser_molecular_png/TPCN01469.png)
| Name | Ligulamulienin B |
| Molecular Formula | C29H38O3 |
| Molecular Weight | 434.62 |
| CAS Registry Number | 1252574-90-5 |
| SMILES | CC(=O)C1=C(Oc2oc3cc4c(c(C)c3c2C)C(C)CCC4)CC2CCCC(C)C2(C)C1 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Ligularia muliensis | Subterraneous stems | 0.000421% | Chem Pharm Bull (Tokyo) 58(4): 467-469.(2010) | 10.1248/cpb.58.467 |
Properties
| HBA | 3 | HBD | 0 |
| HeavyAtoms | 32 | AlogP | 7.95 |
| TPSA | 39.44 | RotatableBonds | 3 |
| FractionCSP3 | 0.62 | Rings | 5 |
| AromaticRings | 2 | AliphaticRings | 3 |