TPCN00691
![[object Object]](../../static/browser_molecular_png/TPCN00691.png)
| Name | Mappianines A |
| Molecular Formula | C22H20N2O8 |
| Molecular Weight | 440.41 |
| CAS Registry Number | 2156608-27-2 |
| SMILES | COC(=O)C1=COC(C)C2C(=O)N3C(C(=O)O)Cc4c([nH]c5ccccc45)C(=O)C3(O)C12 |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Icacinaceae | Mappianthus iodoides | Stems | 0.000048% | Phytochemistry, 2018, 145, 68-76. | 10.1016/j.phytochem.2017.10.009 |
Properties
| HBA | 10 | HBD | 3 |
| HeavyAtoms | 32 | AlogP | 0.60 |
| TPSA | 146.23 | RotatableBonds | 2 |
| FractionCSP3 | 0.36 | Rings | 5 |
| AromaticRings | 2 | AliphaticRings | 3 |