N-[7-Hydroxy-8-(hydroxymethyl)-4-[2-[(1-hydroxy-4-methylpentan-2-yl)amino]-2-oxoethyl]-4a,8-dimethyl-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-2-yl]furan-2-carboxamide

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Systematic / IUPAC Name: N-[7-Hydroxy-8-(hydroxymethyl)-4-{2-[(1-hydroxy-4-methyl-2-pentanyl)amino]-2-oxoethyl}-4a,8-dimethyl-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl]-2-furamide

ID: Reference8937

Other Names: Naphtho[2,3-d]thiazole-4-acetamide, 2-[(2-furanylcarbonyl)amino]-4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-N-[1-(hydroxymethyl)-3-methylbutyl]-4a,8-dimethyl-;
NAT8-264185

Formula: C27H39N3O6S

Spectral Data

N-[7-Hydroxy-8-(hydroxymethyl)-4-[2-[(1-hydroxy-4-methylpentan-2-yl)amino]-2-oxoethyl]-4a,8-dimethyl-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-2-yl]furan-2-carboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 1507
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 9/20/2019 7:32:14 AM
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Identificators

InChI InChI=1S/C27H39N3O6S/c1-15(2)10-16(13-31)28-22(34)11-17-23-19(37-25(29-23)30-24(35)18-6-5-9-36-18)12-20-26(17,3)8-7-21(33)27(20,4)14-32/h5-6,9,15-17,20-21,31-33H,7-8,10-14H2,1-4H3,(H,28,34)(H,29,30,35)
InChI Key VGGHRFWAASSRLR-UHFFFAOYSA-N
Canonical SMILES CC(C)CC(CO)NC(=O)CC1C2=C(CC3C1(CCC(C3(C)CO)O)C)SC(=N2)NC(=O)C4=CC=CO4
CAS
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Other Names Naphtho[2,3-d]thiazole-4-acetamide, 2-[(2-furanylcarbonyl)amino]-4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-N-[1-(hydroxymethyl)-3-methylbutyl]-4a,8-dimethyl-;
NAT8-264185

In Other Databases

ChemSpider 2942434
PubChem 3711092