(1S)-1,5-Anhydro-2,3,6-trideoxy-1-{[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl}-6-[(1-methyl-4-piperidinyl)amino]-D-erythro-hexitol

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Systematic / IUPAC Name: (2R,3S,6S)-6-[[5-(4-Methoxyphenyl)-1,2-oxazol-3-yl]methyl]-2-[[(1-methylpiperidin-4-yl)amino]methyl]oxan-3-ol

ID: Reference11291

Other Names: D-Arabino-heptitol, 2,6-anhydro-1,3,4,7-tetradeoxy-1-[5-(4-methoxyphenyl)-3-isoxazolyl]-7-[(1-methyl-4-piperidinyl)amino]-;
NAT12-540907

Formula: C23H33N3O4

Spectral Data

(1S)-1,5-Anhydro-2,3,6-trideoxy-1-{[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl}-6-[(1-methyl-4-piperidinyl)amino]-D-erythro-hexitol 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 305
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 3/17/2022 12:33:07 PM
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Identificators

InChI InChI=1S/C23H33N3O4/c1-26-11-9-17(10-12-26)24-15-23-21(27)8-7-20(29-23)13-18-14-22(30-25-18)16-3-5-19(28-2)6-4-16/h3-6,14,17,20-21,23-24,27H,7-13,15H2,1-2H3/t20-,21-,23+/m0/s1
InChI Key ZKOSZOKGYSBARL-QNWVGRARSA-N
Canonical SMILES CN1CCC(CC1)NCC2C(CCC(O2)CC3=NOC(=C3)C4=CC=C(C=C4)OC)O
CAS
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Other Names D-Arabino-heptitol, 2,6-anhydro-1,3,4,7-tetradeoxy-1-[5-(4-methoxyphenyl)-3-isoxazolyl]-7-[(1-methyl-4-piperidinyl)amino]-;
NAT12-540907

In Other Databases

PubChem 75536405
ChemSpider 29856728