TPCN00809
![[object Object]](../../static/browser_molecular_png/TPCN00809.png)
| Name | Uncarialin I;Uncarialins I |
| Molecular Formula | C21H26N2O4 |
| Molecular Weight | 370.45 |
| CAS Registry Number | 2593378-86-8 |
| SMILES | C=CC1C[N+]2([O-])CCc3c([nH]c4ccccc34)C2CC1C(CO)C(=O)OC |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Rubiaceae | Uncaria rhynchophylla | Hooks | 0.000005% | J Nat Prod, 2019, 82, 3302-3310. | 10.1021/acs.jnatprod.9b00532 |
| Rubiaceae | Uncaria rhynchophylla | Stems | 0.000005% | Journal of Natural Products 83 | 10.1021/acs.jnatprod.9b00532 |
Properties
| HBA | 6 | HBD | 2 |
| HeavyAtoms | 27 | AlogP | 2.68 |
| TPSA | 85.38 | RotatableBonds | 4 |
| FractionCSP3 | 0.48 | Rings | 4 |
| AromaticRings | 2 | AliphaticRings | 2 |