1,4:3,6-Dianhydro-2-[(cyclohexylcarbonyl)amino]-2-deoxy-5-O-[(4-phenoxyphenyl)carbamoyl]-D-glucitol

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Systematic / IUPAC Name: [(3S,3aR,6R,6aS)-3-(Cyclohexanecarbonylamino)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] N-(4-phenoxyphenyl)carbamate

ID: Reference12360

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-[(cyclohexylcarbonyl)amino]-2-deoxy-, 5-[(4-phenoxyphenyl)carbamate];
NAT6-270069

Formula: C26H30N2O6

Spectral Data

1,4:3,6-Dianhydro-2-[(cyclohexylcarbonyl)amino]-2-deoxy-5-O-[(4-phenoxyphenyl)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 2115
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/10/2023 8:33:46 AM
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Identificators

InChI InChI=1S/C26H30N2O6/c29-25(17-7-3-1-4-8-17)28-21-15-31-24-22(16-32-23(21)24)34-26(30)27-18-11-13-20(14-12-18)33-19-9-5-2-6-10-19/h2,5-6,9-14,17,21-24H,1,3-4,7-8,15-16H2,(H,27,30)(H,28,29)/t21-,22+,23+,24+/m0/s1
InChI Key JSYWMNPHJVJHEP-OLKYXYMISA-N
Canonical SMILES C1CCC(CC1)C(=O)NC2COC3C2OCC3OC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-[(cyclohexylcarbonyl)amino]-2-deoxy-, 5-[(4-phenoxyphenyl)carbamate];
NAT6-270069

In Other Databases

ChemSpider 10058352
PubChem 11884024