Systematic / IUPAC Name: N-[(4S,4aR,7R,8R,8aS)-4-[2-(Cyclopentylamino)-2-oxoethyl]-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-2-yl]furan-2-carboxamide
ID: Reference8836
Other Names:
Naphtho[2,3-d]thiazole-4-acetamide, N-cyclopentyl-2-[(2-furanylcarbonyl)amino]-4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-, (4S,4aR,7R,8R,8aS)-;
NAT8-264164
Formula: C26H35N3O5S
N-[(4S,4aR,7R,8R,8aS)-4-[2-(Cyclopentylamino)-2-oxoethyl]-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-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 | 1711 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5, MS6 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 8/12/2019 7:03:00 AM |
InChI | InChI=1S/C26H35N3O5S/c1-25-10-9-20(31)26(2,14-30)19(25)13-18-22(16(25)12-21(32)27-15-6-3-4-7-15)28-24(35-18)29-23(33)17-8-5-11-34-17/h5,8,11,15-16,19-20,30-31H,3-4,6-7,9-10,12-14H2,1-2H3,(H,27,32)(H,28,29,33)/t16-,19+,20-,25+,26+/m1/s1 |
InChI Key | YKXSPQCJBVUOHT-MVLGBMNWSA-N |
Canonical SMILES | CC12CCC(C(C1CC3=C(C2CC(=O)NC4CCCC4)N=C(S3)NC(=O)C5=CC=CO5)(C)CO)O |
CAS | |
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Other Names |
Naphtho[2,3-d]thiazole-4-acetamide, N-cyclopentyl-2-[(2-furanylcarbonyl)amino]-4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-, (4S,4aR,7R,8R,8aS)-; NAT8-264164 |