TPCN00310
![[object Object]](../../static/browser_molecular_png/TPCN00310.png)
| Name | Picrocrocinic acid |
| Molecular Formula | C16H26O8 |
| Molecular Weight | 346.38 |
| CAS Registry Number | 62218-53-5 |
| SMILES | CC1=C(C(=O)O)C(C)(C)CC(OC2OC(CO)C(O)C(O)C2O)C1 |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Rubiaceae | Gardeniae fructus | Fruits | 0.000593% | Chem Biodivers, 2012, 9, 1490-1509. | 10.1002/cbdv.201200030 |
Properties
| HBA | 8 | HBD | 5 |
| HeavyAtoms | 24 | AlogP | -0.61 |
| TPSA | 136.68 | RotatableBonds | 4 |
| FractionCSP3 | 0.81 | Rings | 2 |
| AromaticRings | 0 | AliphaticRings | 2 |