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

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

ID: Reference11220

Other Names: D-Arabino-heptitol, 2,6-anhydro-7-(cyclohexylamino)-1,3,4,7-tetradeoxy-1-[5-(methoxymethyl)-3-isoxazolyl]-;
NAT12-540459

Formula: C18H30N2O4

Spectral Data

(1S)-1,5-Anhydro-6-(cyclohexylamino)-2,3,6-trideoxy-1-{[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl}-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 2020
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 2/18/2022 7:38:54 AM
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Identificators

InChI InChI=1S/C18H30N2O4/c1-22-12-16-10-14(20-24-16)9-15-7-8-17(21)18(23-15)11-19-13-5-3-2-4-6-13/h10,13,15,17-19,21H,2-9,11-12H2,1H3/t15-,17-,18+/m0/s1
InChI Key HLWZPTFDGGLTTF-RYQLBKOJSA-N
Canonical SMILES COCC1=CC(=NO1)CC2CCC(C(O2)CNC3CCCCC3)O
CAS
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Other Names D-Arabino-heptitol, 2,6-anhydro-7-(cyclohexylamino)-1,3,4,7-tetradeoxy-1-[5-(methoxymethyl)-3-isoxazolyl]-;
NAT12-540459

In Other Databases

ChemSpider 29856557
PubChem 75536291