TPCN00267
![[object Object]](../../static/browser_molecular_png/TPCN00267.png)
| Name | Delavayines B |
| Molecular Formula | C21H25NO4 |
| Molecular Weight | 355.43 |
| CAS Registry Number | 316381-82-5 |
| SMILES | COC(OC)c1c[n+](C(Cc2ccccc2)C(=O)[O-])cc2c1CCC2C |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Bignoniaceae | Incarvillea delavayi | Aerial parts | 0.000800% | Chem Pharm Bull (Tokyo), 2000, 48, 1826-1827. | 10.1248/cpb.48.1826 |
Properties
| HBA | 5 | HBD | 0 |
| HeavyAtoms | 26 | AlogP | 1.85 |
| TPSA | 62.47 | RotatableBonds | 7 |
| FractionCSP3 | 0.43 | Rings | 3 |
| AromaticRings | 2 | AliphaticRings | 1 |