TPCN05853
![[object Object]](../../static/browser_molecular_png/TPCN05853.png)
| Name | Cimitriteromone F |
| Molecular Formula | C57H82O19 |
| Molecular Weight | 1071.26 |
| CAS Registry Number | 2245241-49-8 |
| SMILES | COc1c2c(cc3oc(COC4OC(COC56OC7CC8(C)C9CCC%10C(C)(C)C(OC%11OCC(O)C(O)C%11O)CCC%10%11CC9%11CCC8(C)C7C(C)C5OC(C)(C)C6O)C(O)C(O)C4O)cc(=O)c13)OC(C(C)(C)O)C2 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ranunculaceae | Cimicifuga foetida | Subterraneous stems | 0.000069% | J Org Chem. 2018 Sep 7;83(17):10359-10369. | 10.1021/acs.joc.8b01466. |
Properties
| HBA | 19 | HBD | 8 |
| HeavyAtoms | 76 | AlogP | 3.36 |
| TPSA | 275.12 | RotatableBonds | 10 |
| FractionCSP3 | 0.84 | Rings | 12 |
| AromaticRings | 2 | AliphaticRings | 10 |