TPCN02572
![[object Object]](../../static/browser_molecular_png/TPCN02572.png)
| Name | Schaffnerine |
| Molecular Formula | C40H60O6 |
| Molecular Weight | 636.91 |
| CAS Registry Number | 1449744-89-1 |
| SMILES | CC1(C)CCCC2(C)C3CCC4=C5C(OCC4)OC4CC6C(C)(C)CCCC6(C)C6CCC7=C(C(OCC7)OC(CC12)OC53)C6O4 |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Fabaceae | Acanthophyllum glandulosum | Aerial parts | 0.000667% | Org Lett 15, 4658-4661 (2013). | 10.1021/ol401890v |
Properties
| HBA | 6 | HBD | 0 |
| HeavyAtoms | 46 | AlogP | 8.83 |
| TPSA | 55.38 | RotatableBonds | 0 |
| FractionCSP3 | 0.90 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |