1,4:3,6-Dianhydro-2-(benzoylamino)-2-deoxy-5-O-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-D-glucitol

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Systematic / IUPAC Name: Ethyl 3-[[(3S,3aR,6R,6aS)-3-benzamido-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxycarbonylamino]benzoate

ID: Reference12213

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-(benzoylamino)-2-deoxy-, 5-[[3-(ethoxycarbonyl)phenyl]carbamate];
NAT6-269996

Formula: C23H24N2O7

Spectral Data

1,4:3,6-Dianhydro-2-(benzoylamino)-2-deoxy-5-O-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-D-glucitol 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 2705
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 2/3/2023 9:04:56 AM
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Identificators

InChI InChI=1S/C23H24N2O7/c1-2-29-22(27)15-9-6-10-16(11-15)24-23(28)32-18-13-31-19-17(12-30-20(18)19)25-21(26)14-7-4-3-5-8-14/h3-11,17-20H,2,12-13H2,1H3,(H,24,28)(H,25,26)/t17-,18+,19+,20+/m0/s1
InChI Key ZPHNRVJCXANIFK-MTQWCTHYSA-N
Canonical SMILES CCOC(=O)C1=CC(=CC=C1)NC(=O)OC2COC3C2OCC3NC(=O)C4=CC=CC=C4
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-(benzoylamino)-2-deoxy-, 5-[[3-(ethoxycarbonyl)phenyl]carbamate];
NAT6-269996

In Other Databases

ChemSpider 10058343
PubChem 11884015