1,4-Anhydro-2,5-dideoxy-2-[(1H-imidazol-4-ylmethyl)amino]-5-[(isopropylcarbamoyl)amino]-D-arabinitol

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Systematic / IUPAC Name: 1-[[(2R,3S,4R)-3-Hydroxy-4-(1H-imidazol-5-ylmethylamino)oxolan-2-yl]methyl]-3-propan-2-ylurea

ID: Reference12745

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(1H-imidazol-4-ylmethyl)amino]-5-[[[(1-methylethyl)amino]carbonyl]amino]-;
NAT19-551729

Formula: C13H23N5O3

Spectral Data

1,4-Anhydro-2,5-dideoxy-2-[(1H-imidazol-4-ylmethyl)amino]-5-[(isopropylcarbamoyl)amino]-D-arabinitol 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 875
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 9/11/2023 12:49:05 PM
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Identificators

InChI InChI=1S/C13H23N5O3/c1-8(2)18-13(20)16-5-11-12(19)10(6-21-11)15-4-9-3-14-7-17-9/h3,7-8,10-12,15,19H,4-6H2,1-2H3,(H,14,17)(H2,16,18,20)/t10-,11-,12+/m1/s1
InChI Key YZKRLJURTGAGRA-UTUOFQBUSA-N
Canonical SMILES CC(C)NC(=O)NCC1C(C(CO1)NCC2=CN=CN2)O
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(1H-imidazol-4-ylmethyl)amino]-5-[[[(1-methylethyl)amino]carbonyl]amino]-;
NAT19-551729

In Other Databases

ChemSpider 29858655
PubChem 75536736