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

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

ID: Reference11057

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[[(phenylmethyl)amino]carbonyl]amino]-, 5-[[4-(1-methylethyl)phenyl]carbamate]

Formula: C24H29N3O5

Spectral Data

1,4:3,6-Dianhydro-2-[(benzylcarbamoyl)amino]-2-deoxy-5-O-[(4-isopropylphenyl)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 2230
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/26/2021 8:38:44 AM
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Identificators

InChI InChI=1S/C24H29N3O5/c1-15(2)17-8-10-18(11-9-17)26-24(29)32-20-14-31-21-19(13-30-22(20)21)27-23(28)25-12-16-6-4-3-5-7-16/h3-11,15,19-22H,12-14H2,1-2H3,(H,26,29)(H2,25,27,28)/t19-,20+,21+,22+/m0/s1
InChI Key UFAXEAFCAOWJLV-DXBBTUNJSA-N
Canonical SMILES CC(C)C1=CC=C(C=C1)NC(=O)OC2COC3C2OCC3NC(=O)NCC4=CC=CC=C4
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[[(phenylmethyl)amino]carbonyl]amino]-, 5-[[4-(1-methylethyl)phenyl]carbamate]

In Other Databases

ChemSpider 10058431
PubChem 11884103