2,5-Anhydro-4,6-dideoxy-6-{[(1-methyl-1H-pyrrol-2-yl)carbonyl]amino}-4-(4-phenyl-1-piperazinyl)-D-glucitol

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Systematic / IUPAC Name: N-[[(2R,4S,5S)-4-Hydroxy-5-(hydroxymethyl)-3-(4-phenylpiperazin-1-yl)oxolan-2-yl]methyl]-1-methylpyrrole-2-carboxamide

ID: Reference12126

Other Names: D-Glucitol, 2,5-anhydro-4,6-dideoxy-6-[[(1-methyl-1H-pyrrol-2-yl)carbonyl]amino]-4-(4-phenyl-1-piperazinyl)-;
NAT27-401047

Formula: C22H30N4O4

Spectral Data

2,5-Anhydro-4,6-dideoxy-6-{[(1-methyl-1H-pyrrol-2-yl)carbonyl]amino}-4-(4-phenyl-1-piperazinyl)-D-glucitol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 885
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 1/13/2023 8:46:44 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C22H30N4O4/c1-24-9-5-8-17(24)22(29)23-14-18-20(21(28)19(15-27)30-18)26-12-10-25(11-13-26)16-6-3-2-4-7-16/h2-9,18-21,27-28H,10-15H2,1H3,(H,23,29)/t18-,19+,20?,21-/m1/s1
InChI Key UJIGVYVTXAHSLS-JGUMPVPUSA-N
Canonical SMILES CN1C=CC=C1C(=O)NCC2C(C(C(O2)CO)O)N3CCN(CC3)C4=CC=CC=C4
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Other Names D-Glucitol, 2,5-anhydro-4,6-dideoxy-6-[[(1-methyl-1H-pyrrol-2-yl)carbonyl]amino]-4-(4-phenyl-1-piperazinyl)-;
NAT27-401047

In Other Databases

PubChem 45361282
ChemSpider 22807049