N-{(1S,2S,8S,8aS)-7-[(2S)-1-(Benzylamino)-1-oxo-2-propanyl]-8-hydroxy-1,4a-dimethyldecahydro-2-naphthalenyl}-2-pyridinecarboxamide
N-{(1S,2S,8S,8aS)-7-[(2S)-1-(Benzylamino)-1-oxo-2-propanyl]-8-hydroxy-1,4a-dimethyldecahydro-2-naphthalenyl}-2-pyridinecarboxamide Structure
Systematic / IUPAC Name: N-[(1S,2S,4aS,8S,8aS)-7-[(2S)-1-(Benzylamino)-1-oxopropan-2-yl]-8-hydroxy-1,4a-dimethyl-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl]pyridine-2-carboxamide
ID: Reference9664
Other Names:
2-Pyridinecarboxamide, N-[(1S,2S,8S,8aS)-decahydro-8-hydroxy-1,4a-dimethyl-7-[(1S)-1-methyl-2-oxo-2-[(phenylmethyl)amino]ethyl]-2-naphthalenyl]-;
NAT5-397825
Formula: C28H37N3O3
Spectral Data
N-{(1S,2S,8S,8aS)-7-[(2S)-1-(Benzylamino)-1-oxo-2-propanyl]-8-hydroxy-1,4a-dimethyldecahydro-2-naphthalenyl}-2-pyridinecarboxamide 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 | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 1603 |
| Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 5/11/2020 8:09:15 AM |
Identificators
| InChI | InChI=1S/C28H37N3O3/c1-18(26(33)30-17-20-9-5-4-6-10-20)21-12-14-28(3)15-13-22(19(2)24(28)25(21)32)31-27(34)23-11-7-8-16-29-23/h4-11,16,18-19,21-22,24-25,32H,12-15,17H2,1-3H3,(H,30,33)(H,31,34)/t18-,19+,21?,22-,24+,25-,28-/m0/s1 |
| InChI Key | KAJQAPBZMVZVNH-TYBDQHKBSA-N |
| Canonical SMILES | CC1C(CCC2(C1C(C(CC2)C(C)C(=O)NCC3=CC=CC=C3)O)C)NC(=O)C4=CC=CC=N4 |
| CAS | |
| Splash | |
| Other Names |
2-Pyridinecarboxamide, N-[(1S,2S,8S,8aS)-decahydro-8-hydroxy-1,4a-dimethyl-7-[(1S)-1-methyl-2-oxo-2-[(phenylmethyl)amino]ethyl]-2-naphthalenyl]-; NAT5-397825 |