TPCN00582
![[object Object]](../../static/browser_molecular_png/TPCN00582.png)
| Name | Demethylisoalangiside |
| Molecular Formula | C24H29NO10 |
| Molecular Weight | 491.49 |
| CAS Registry Number | 169531-70-8 |
| SMILES | C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)N3CCc4cc(O)c(O)cc4C3CC21 |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Rubiaceae | Cephaelis acuminata | Roots | 0.000122% | Phytochemistry, 2002, 59, 91-97. | 10.1016/s0031-9422(01)00418-6 |
Properties
| HBA | 11 | HBD | 6 |
| HeavyAtoms | 35 | AlogP | -0.60 |
| TPSA | 169.38 | RotatableBonds | 4 |
| FractionCSP3 | 0.54 | Rings | 5 |
| AromaticRings | 1 | AliphaticRings | 4 |