N-[(1S,2S,8S,8aS)-7-{(2S)-1-[(2-Furylmethyl)amino]-1-oxo-2-propanyl}-8-hydroxy-1,4a-dimethyldecahydro-2-naphthalenyl]-5-pyrimidinecarboxamide
N-[(1S,2S,8S,8aS)-7-{(2S)-1-[(2-Furylmethyl)amino]-1-oxo-2-propanyl}-8-hydroxy-1,4a-dimethyldecahydro-2-naphthalenyl]-5-pyrimidinecarboxamide Structure
Systematic / IUPAC Name: N-[(1S,2S,4aS,8S,8aS)-7-[(2S)-1-(Furan-2-ylmethylamino)-1-oxopropan-2-yl]-8-hydroxy-1,4a-dimethyl-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-2-yl]pyrimidine-5-carboxamide
ID: Reference13334
Other Names:
5-Pyrimidinecarboxamide, N-[(1S,2S,8S,8aS)-7-[(1S)-2-[(2-furanylmethyl)amino]-1-methyl-2-oxoethyl]decahydro-8-hydroxy-1,4a-dimethyl-2-naphthalenyl]-;
NAT5-397879
Formula: C25H34N4O4
Spectral Data
N-[(1S,2S,8S,8aS)-7-{(2S)-1-[(2-Furylmethyl)amino]-1-oxo-2-propanyl}-8-hydroxy-1,4a-dimethyldecahydro-2-naphthalenyl]-5-pyrimidinecarboxamide 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 | 3363 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 1/31/2025 12:07:38 PM |
Identificators
| InChI | InChI=1S/C25H34N4O4/c1-15(23(31)28-13-18-5-4-10-33-18)19-6-8-25(3)9-7-20(16(2)21(25)22(19)30)29-24(32)17-11-26-14-27-12-17/h4-5,10-12,14-16,19-22,30H,6-9,13H2,1-3H3,(H,28,31)(H,29,32)/t15-,16+,19?,20-,21+,22-,25-/m0/s1 |
| InChI Key | BRODIQDILIETNE-ZTICUPJXSA-N |
| Canonical SMILES | CC1C(CCC2(C1C(C(CC2)C(C)C(=O)NCC3=CC=CO3)O)C)NC(=O)C4=CN=CN=C4 |
| CAS | |
| Splash | |
| Other Names |
5-Pyrimidinecarboxamide, N-[(1S,2S,8S,8aS)-7-[(1S)-2-[(2-furanylmethyl)amino]-1-methyl-2-oxoethyl]decahydro-8-hydroxy-1,4a-dimethyl-2-naphthalenyl]-; NAT5-397879 |