2,5-Anhydro-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-6-[(2-thienylcarbonyl)amino]-D-galactitol

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

ID: Reference11600

Other Names: D-Galactitol, 2,5-anhydro-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-6-[(2-thienylcarbonyl)amino]-;
NAT27-401046

Formula: C21H27N3O4S

Spectral Data

2,5-Anhydro-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-6-[(2-thienylcarbonyl)amino]-D-galactitol 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 2084
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 8/1/2022 9:11:55 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C21H27N3O4S/c25-14-17-20(26)19(16(28-17)13-22-21(27)18-7-4-12-29-18)24-10-8-23(9-11-24)15-5-2-1-3-6-15/h1-7,12,16-17,19-20,25-26H,8-11,13-14H2,(H,22,27)/t16-,17+,19+,20-/m1/s1
InChI Key ACSXWXDHNBHLIB-LCLWPZTBSA-N
Canonical SMILES C1CN(CCN1C2C(OC(C2O)CO)CNC(=O)C3=CC=CS3)C4=CC=CC=C4
CAS
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Other Names D-Galactitol, 2,5-anhydro-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-6-[(2-thienylcarbonyl)amino]-;
NAT27-401046

In Other Databases

ChemSpider 29849285
PubChem 75536044