TPCN04555
![[object Object]](../../static/browser_molecular_png/TPCN04555.png)
| Name | Ulmicin C |
| Molecular Formula | C45H60O8 |
| Molecular Weight | 728.97 |
| CAS Registry Number | 336621-24-0 |
| SMILES | C=C(C)C1CCC2(C)CC(OC(=O)c3ccc(O)cc3)C3(C)C(CC(OC(=O)c4ccc(O)c(OC)c4)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C12 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ulmaceae | Ulmus davidiana | Whole plants | 0.000280% | J Nat Prod 64(3): 328-331. | 10.1021/np0004799 |
Properties
| HBA | 8 | HBD | 3 |
| HeavyAtoms | 53 | AlogP | 9.12 |
| TPSA | 122.52 | RotatableBonds | 6 |
| FractionCSP3 | 0.64 | Rings | 7 |
| AromaticRings | 2 | AliphaticRings | 5 |