TPCN01179
![[object Object]](../../static/browser_molecular_png/TPCN01179.png)
| Name | Arbusculin A |
| Molecular Formula | C15H22O3 |
| Molecular Weight | 250.34 |
| CAS Registry Number | 27652-22-8 |
| SMILES | C=C1C(=O)OC2C1CCC1(C)CCCC(C)(O)C21 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Saussurea lappa | Roots | 0.001520% | J Nat Prod 66(9): 1175-1180.(2003) | 10.1021/np030147e |
| Asteraceae | Saussurea lappa | Roots | 0.000048% | Planta Med 84(5): 329-335.(2018) | 10.1055/s-0043-120115 |
Properties
| HBA | 3 | HBD | 1 |
| HeavyAtoms | 18 | AlogP | 2.44 |
| TPSA | 46.53 | RotatableBonds | 0 |
| FractionCSP3 | 0.80 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |