1,4-Anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-{[(1-methyl-1H-imidazol-2-yl)methyl]amino}-D-arabinitol

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Systematic / IUPAC Name: 4-Fluoro-N-[[(2R,3S,4R)-3-hydroxy-4-[(1-methylimidazol-2-yl)methylamino]oxolan-2-yl]methyl]benzamide

ID: Reference13058

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[[(1-methyl-1H-imidazol-2-yl)methyl]amino]-;
NAT19-551484

Formula: C17H21FN4O3

Spectral Data

1,4-Anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-{[(1-methyl-1H-imidazol-2-yl)methyl]amino}-D-arabinitol 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 465
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 3/11/2024 2:04:59 PM
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Identificators

InChI InChI=1S/C17H21FN4O3/c1-22-7-6-19-15(22)9-20-13-10-25-14(16(13)23)8-21-17(24)11-2-4-12(18)5-3-11/h2-7,13-14,16,20,23H,8-10H2,1H3,(H,21,24)/t13-,14-,16+/m1/s1
InChI Key JZGPKSFRBNDPBQ-FMKPAKJESA-N
Canonical SMILES CN1C=CN=C1CNC2COC(C2O)CNC(=O)C3=CC=C(C=C3)F
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[[(1-methyl-1H-imidazol-2-yl)methyl]amino]-;
NAT19-551484

In Other Databases

ChEMBL CHEMBL5025637
ChemSpider 29858555
PubChem 75536647