TPCN02595
![[object Object]](../../static/browser_molecular_png/TPCN02595.png)
| Name | Subtoxin B |
| Molecular Formula | C34H50O8 |
| Molecular Weight | 586.77 |
| CAS Registry Number | 73025-06-6 |
| SMILES | CCCCCCCCCC=CC=CC(=O)OC12CC(C)C3(O)C(C4OC4(CO)C(O)C4(O)C(=O)C(C)=CC43)C1C2(C)C |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Thymelaeaceae | Pimelea elongata | Leaves | 0.000580% | J Nat Prod 73, 1907-1913 (2010). | 10.1021/np1005746 |
Properties
| HBA | 8 | HBD | 4 |
| HeavyAtoms | 42 | AlogP | 3.95 |
| TPSA | 136.82 | RotatableBonds | 12 |
| FractionCSP3 | 0.76 | Rings | 5 |
| AromaticRings | 0 | AliphaticRings | 5 |