2-{[(4-Acetamidophenyl)sulfonyl]amino}-5-O-(2-amino-2-oxoethyl)-1,4:3,6-dianhydro-2-deoxy-D-glucitol

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Systematic / IUPAC Name: 2-[[(3S,3aR,6R,6aS)-3-[(4-Acetamidophenyl)sulfonylamino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]acetamide

ID: Reference12439

Other Names: D-Glucitol, 2-[[[4-(acetylamino)phenyl]sulfonyl]amino]-5-O-(2-amino-2-oxoethyl)-1,4:3,6-dianhydro-2-deoxy-;
NAT6-269391

Formula: C16H21N3O7S

Spectral Data

2-{[(4-Acetamidophenyl)sulfonyl]amino}-5-O-(2-amino-2-oxoethyl)-1,4:3,6-dianhydro-2-deoxy-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 1828
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/6/2023 12:41:36 PM
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Identificators

InChI InChI=1S/C16H21N3O7S/c1-9(20)18-10-2-4-11(5-3-10)27(22,23)19-12-6-25-16-13(7-26-15(12)16)24-8-14(17)21/h2-5,12-13,15-16,19H,6-8H2,1H3,(H2,17,21)(H,18,20)/t12-,13+,15+,16+/m0/s1
InChI Key PEBSWEXWCCMWCF-SJXGUFTOSA-N
Canonical SMILES CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2COC3C2OCC3OCC(=O)N
CAS
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Other Names D-Glucitol, 2-[[[4-(acetylamino)phenyl]sulfonyl]amino]-5-O-(2-amino-2-oxoethyl)-1,4:3,6-dianhydro-2-deoxy-;
NAT6-269391

In Other Databases

PubChem 11883287
ChemSpider 10057615