TPCN00629
![[object Object]](../../static/browser_molecular_png/TPCN00629.png)
| Name | 6''-O-a-d-glucopyranosyl-6-O-methyl-N-deacetylisoipecosidic acid |
| Molecular Formula | C31H43NO16 |
| Molecular Weight | 685.68 |
| CAS Registry Number | 342036-88-8 |
| SMILES | C=CC1C(OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)OC=C(C(=O)O)C1CC1NCCc2cc(OC)c(O)cc21 |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Cornaceae | Alangium lamarckii | Fruits | 0.000082% | Phytochemistry, 2001, 56, 623-630. | 10.1016/s0031-9422(00)00417-9 |
Properties
| HBA | 17 | HBD | 10 |
| HeavyAtoms | 48 | AlogP | -2.64 |
| TPSA | 266.55 | RotatableBonds | 11 |
| FractionCSP3 | 0.65 | Rings | 5 |
| AromaticRings | 1 | AliphaticRings | 4 |