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

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Systematic / IUPAC Name: N-[[(2R,3S,6S)-3-Hydroxy-6-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]oxan-2-yl]methyl]-2-phenoxyacetamide

ID: Reference11182

Other Names: D-Arabino-heptitol, 2,6-anhydro-1,3,4,7-tetradeoxy-1-[5-(methoxymethyl)-3-isoxazolyl]-7-[(2-phenoxyacetyl)amino]-;
NAT12-540422

Formula: C20H26N2O6

Spectral Data

(1S)-1,5-Anhydro-2,3,6-trideoxy-1-{[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl}-6-[(phenoxyacetyl)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 2331
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 2/4/2022 11:34:01 AM
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Identificators

InChI InChI=1S/C20H26N2O6/c1-25-12-17-10-14(22-28-17)9-16-7-8-18(23)19(27-16)11-21-20(24)13-26-15-5-3-2-4-6-15/h2-6,10,16,18-19,23H,7-9,11-13H2,1H3,(H,21,24)/t16-,18-,19+/m0/s1
InChI Key UJEQOIYUGKUSRE-YTQUADARSA-N
Canonical SMILES COCC1=CC(=NO1)CC2CCC(C(O2)CNC(=O)COC3=CC=CC=C3)O
CAS
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Other Names D-Arabino-heptitol, 2,6-anhydro-1,3,4,7-tetradeoxy-1-[5-(methoxymethyl)-3-isoxazolyl]-7-[(2-phenoxyacetyl)amino]-;
NAT12-540422

In Other Databases

ChemSpider 29856532
PubChem 75536274