N-[(1S,2S,8S,8aS)-7-{(2S)-1-[(3,4-Dimethoxybenzyl)amino]-1-oxo-2-propanyl}-8-hydroxy-1,4a-dimethyldecahydro-2-naphthalenyl]-2-pyridinecarboxamide
N-[(1S,2S,8S,8aS)-7-{(2S)-1-[(3,4-Dimethoxybenzyl)amino]-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-[(3,4-Dimethoxyphenyl)methylamino]-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: Reference9663
Other Names:
2-Pyridinecarboxamide, N-[(1S,2S,8S,8aS)-7-[(1S)-2-[[(3,4-dimethoxyphenyl)methyl]amino]-1-methyl-2-oxoethyl]decahydro-8-hydroxy-1,4a-dimethyl-2-naphthalenyl]-;
NAT5-397856
Formula: C30H41N3O5
Spectral Data
N-[(1S,2S,8S,8aS)-7-{(2S)-1-[(3,4-Dimethoxybenzyl)amino]-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 | 2339 |
| Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 5/11/2020 8:06:38 AM |
Identificators
| InChI | InChI=1S/C30H41N3O5/c1-18(28(35)32-17-20-9-10-24(37-4)25(16-20)38-5)21-11-13-30(3)14-12-22(19(2)26(30)27(21)34)33-29(36)23-8-6-7-15-31-23/h6-10,15-16,18-19,21-22,26-27,34H,11-14,17H2,1-5H3,(H,32,35)(H,33,36)/t18-,19+,21?,22-,26+,27-,30-/m0/s1 |
| InChI Key | WQJXETVMYMEECV-VTCDKSGDSA-N |
| Canonical SMILES | CC1C(CCC2(C1C(C(CC2)C(C)C(=O)NCC3=CC(=C(C=C3)OC)OC)O)C)NC(=O)C4=CC=CC=N4 |
| CAS | |
| Splash | |
| Other Names |
2-Pyridinecarboxamide, N-[(1S,2S,8S,8aS)-7-[(1S)-2-[[(3,4-dimethoxyphenyl)methyl]amino]-1-methyl-2-oxoethyl]decahydro-8-hydroxy-1,4a-dimethyl-2-naphthalenyl]-; NAT5-397856 |