TPCN04602
![[object Object]](../../static/browser_molecular_png/TPCN04602.png)
| Name | Celosin M |
| Molecular Formula | C48H76O21 |
| Molecular Weight | 989.12 |
| CAS Registry Number | 1950582-07-6 |
| SMILES | CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OC(CO)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6O)C(C)(C(=O)O)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Amaranthaceae | Celosia cristata | Seeds | 0.000200% | Nat Prod Res 32(2): 167-174. | 10.1080/14786419.2017.1343317 |
Properties
| HBA | 21 | HBD | 13 |
| HeavyAtoms | 69 | AlogP | -1.82 |
| TPSA | 352.51 | RotatableBonds | 10 |
| FractionCSP3 | 0.92 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |