1,4:3,6-Dianhydro-5-O-(cyclohexylcarbamoyl)-2-deoxy-2-[(8-quinolinylsulfonyl)amino]-D-glucitol

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Systematic / IUPAC Name: [(3S,3aR,6R,6aS)-3-(Quinolin-8-ylsulfonylamino)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] N-cyclohexylcarbamate

ID: Reference12436

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[(8-quinolinylsulfonyl)amino]-, 5-(cyclohexylcarbamate);
NAT6-269719

Formula: C22H27N3O6S

Spectral Data

1,4:3,6-Dianhydro-5-O-(cyclohexylcarbamoyl)-2-deoxy-2-[(8-quinolinylsulfonyl)amino]-D-glucitol 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
No. of Spectral Trees 1
No. of Spectra 1398
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/6/2023 11:24:56 AM
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Identificators

InChI InChI=1S/C22H27N3O6S/c26-22(24-15-8-2-1-3-9-15)31-17-13-30-20-16(12-29-21(17)20)25-32(27,28)18-10-4-6-14-7-5-11-23-19(14)18/h4-7,10-11,15-17,20-21,25H,1-3,8-9,12-13H2,(H,24,26)/t16-,17+,20+,21+/m0/s1
InChI Key QXEUEZRVPOVHKW-XWDORNJCSA-N
Canonical SMILES C1CCC(CC1)NC(=O)OC2COC3C2OCC3NS(=O)(=O)C4=CC=CC5=C4N=CC=C5
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[(8-quinolinylsulfonyl)amino]-, 5-(cyclohexylcarbamate);
NAT6-269719

In Other Databases

ChemSpider 10057690
PubChem 11883362