TPCN01393
![[object Object]](../../static/browser_molecular_png/TPCN01393.png)
| Name | Ixerisoside A 6??-O-acetate |
| Molecular Formula | C31H36O12 |
| Molecular Weight | 600.62 |
| CAS Registry Number | 1352840-34-6 |
| SMILES | C=C1CC(OC(=O)Cc2ccc(O)cc2)C2C(=C)C(=O)OC2C2C(=C)C(OC3OC(COC(C)=O)C(O)C(O)C3O)CC12 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Ixeris dentata | Whole plants | 0.000567% | Planta Med 77(4): 380-382.(2011) | 10.1055/s-0030-1250369 |
Properties
| HBA | 12 | HBD | 4 |
| HeavyAtoms | 43 | AlogP | 0.85 |
| TPSA | 178.28 | RotatableBonds | 7 |
| FractionCSP3 | 0.52 | Rings | 5 |
| AromaticRings | 1 | AliphaticRings | 4 |