Systematic / IUPAC Name: N-[7-Hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-2-yl]furan-2-carboxamide
ID: Reference8939
Other Names:
2-Furancarboxamide, N-[4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]naphtho[2,3-d]thiazol-2-yl]-;
NAT8-264189
Formula: C27H37N3O5S
N-{7-Hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl}-2-furamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
No. of Spectral Trees | 1 |
No. of Spectra | 1888 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 9/20/2019 7:48:13 AM |
InChI | InChI=1S/C27H37N3O5S/c1-16-7-10-30(11-8-16)22(33)13-17-23-19(36-25(28-23)29-24(34)18-5-4-12-35-18)14-20-26(17,2)9-6-21(32)27(20,3)15-31/h4-5,12,16-17,20-21,31-32H,6-11,13-15H2,1-3H3,(H,28,29,34) |
InChI Key | NFHGZTRDNXHVQO-UHFFFAOYSA-N |
Canonical SMILES | CC1CCN(CC1)C(=O)CC2C3=C(CC4C2(CCC(C4(C)CO)O)C)SC(=N3)NC(=O)C5=CC=CO5 |
CAS | |
Splash | |
Other Names |
2-Furancarboxamide, N-[4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]naphtho[2,3-d]thiazol-2-yl]-; NAT8-264189 |