TPCN05477
![[object Object]](../../static/browser_molecular_png/TPCN05477.png)
| Name | Scutione |
| Molecular Formula | C90H122O12 |
| Molecular Weight | 1395.95 |
| CAS Registry Number | 247017-66-9 |
| SMILES | COC(=O)C1(C)CCC2(C)CCC3(C)C4=CC=C5C(=CC(=O)C6(O)Oc7c(cc8c(c7C)C7Oc9c(cc%10c(c9C)CCC9C%10(C)CCC%10(C)C%11CC(C)(C(=O)OC)CCC%11(C)CCC9%10C)OC7C7C8(C)CCC8(C)C9CC(C)(C(=O)OC)CCC9(C)CCC78C)OC56C)C4(C)CCC3(C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Celastraceae | Maytenus scutioides | Barks | 0.000567% | Bioorg Med Chem. 1996. 4, 815-820. | 10.1016/0968-0896(96)00078-8. |
Properties
| HBA | 12 | HBD | 1 |
| HeavyAtoms | 102 | AlogP | 19.25 |
| TPSA | 153.12 | RotatableBonds | 3 |
| FractionCSP3 | 0.76 | Rings | 17 |
| AromaticRings | 2 | AliphaticRings | 15 |