1,4:3,6-Dianhydro-2-[5-(4-biphenylyl)-1H-tetrazol-1-yl]-2-deoxy-5-O-[(4-methylphenyl)carbamoyl]-D-glucitol

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Systematic / IUPAC Name: [(3S,3aR,6R,6aS)-3-[5-(4-Phenylphenyl)tetrazol-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] N-(4-methylphenyl)carbamate

ID: Reference12507

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-(5-[1,1'-biphenyl]-4-yl-1H-tetrazol-1-yl)-2-deoxy-, 5-[(4-methylphenyl)carbamate];
NAT6-296415

Formula: C27H25N5O4

Spectral Data

1,4:3,6-Dianhydro-2-[5-(4-biphenylyl)-1H-tetrazol-1-yl]-2-deoxy-5-O-[(4-methylphenyl)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 750
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 5/4/2023 11:53:18 AM
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Identificators

InChI InChI=1S/C27H25N5O4/c1-17-7-13-21(14-8-17)28-27(33)36-23-16-35-24-22(15-34-25(23)24)32-26(29-30-31-32)20-11-9-19(10-12-20)18-5-3-2-4-6-18/h2-14,22-25H,15-16H2,1H3,(H,28,33)/t22-,23+,24+,25+/m0/s1
InChI Key UXGVJRROSVORFA-ZYQDXHPFSA-N
Canonical SMILES CC1=CC=C(C=C1)NC(=O)OC2COC3C2OCC3N4C(=NN=N4)C5=CC=C(C=C5)C6=CC=CC=C6
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-(5-[1,1'-biphenyl]-4-yl-1H-tetrazol-1-yl)-2-deoxy-, 5-[(4-methylphenyl)carbamate];
NAT6-296415

In Other Databases

PubChem 11886074
ChemSpider 10060397