TPCN01838
![[object Object]](../../static/browser_molecular_png/TPCN01838.png)
| Name | Celahin D |
| Molecular Formula | C37H42O13 |
| Molecular Weight | 694.73 |
| CAS Registry Number | 122475-47-2 |
| SMILES | CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)CC(C)C13OC(C)(C)C(C(OC(=O)c1ccccc1)C2OC(=O)c1ccccc1)C3OC(C)=O |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Celastrus hindsii | Stems | 0.000087% | Chem Pharm Bull (Tokyo) 48(7): 1079-1080.(2000) | 10.1248/cpb.48.1079 |
Properties
| HBA | 13 | HBD | 0 |
| HeavyAtoms | 50 | AlogP | 4.00 |
| TPSA | 167.03 | RotatableBonds | 9 |
| FractionCSP3 | 0.51 | Rings | 5 |
| AromaticRings | 2 | AliphaticRings | 3 |