2-Hydroxypropyl nortadalafil
2-Hydroxypropyl nortadalafil Structure
Systematic / IUPAC Name: (6R,12aR)-6-(1,3-Benzodioxol-5-yl)-2-[(2R)-2-hydroxypropyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
ID: Reference3495
Other Names: Pyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione, 6-(1,3-benzodioxol-5-yl)-2,3,6,7,12,12a-hexahydro-2-[(2R)-2-hydroxypropyl]-, (6R,12aR)-
Formula: C24H23N3O5
Class: Counterfeit Drug (Therapeutic) Endogenous Metabolites Therapeutics/Prescription Drugs
Spectral Data
2-Hydroxypropyl nortadalafil mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Plus Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 118 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 12/15/2015 12:57:28 PM |
Identificators
| InChI | InChI=1S/C24H23N3O5/c1-13(28)10-26-11-21(29)27-18(24(26)30)9-16-15-4-2-3-5-17(15)25-22(16)23(27)14-6-7-19-20(8-14)32-12-31-19/h2-8,13,18,23,25,28H,9-12H2,1H3/t13-,18-,23-/m1/s1 |
| InChI Key | YGRCGCUDAOLEEX-GOYXPVIASA-N |
| Canonical SMILES | CC(CN1CC(=O)N2C(C1=O)CC3=C(C2C4=CC5=C(C=C4)OCO5)NC6=CC=CC=C36)O |
| CAS | 1353020855 |
| Splash | |
| Other Names | Pyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione, 6-(1,3-benzodioxol-5-yl)-2,3,6,7,12,12a-hexahydro-2-[(2R)-2-hydroxypropyl]-, (6R,12aR)- |