TPCN00108
![[object Object]](../../static/browser_molecular_png/TPCN00108.png)
| Name | Demethylsecologanol |
| Molecular Formula | C16H24O10 |
| Molecular Weight | 376.36 |
| CAS Registry Number | 872360-10-6 |
| SMILES | C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCO |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Rubiaceae | Ophiorrhiza liukiuensis | Whole plants | 0.004483% | Chem Pharm Bull (Tokyo), 2005, 53, 1355-1358. | 10.1248/cpb.53.1355 |
Properties
| HBA | 10 | HBD | 6 |
| HeavyAtoms | 26 | AlogP | -2.07 |
| TPSA | 166.14 | RotatableBonds | 7 |
| FractionCSP3 | 0.69 | Rings | 2 |
| AromaticRings | 0 | AliphaticRings | 2 |