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

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

ID: Reference11935

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(1H-imidazol-2-ylmethyl)amino]-5-[[(phenylamino)carbonyl]amino]-;
NAT19-551933

Formula: C16H21N5O3

Spectral Data

1,4-Anhydro-2,5-dideoxy-2-[(1H-imidazol-2-ylmethyl)amino]-5-[(phenylcarbamoyl)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 1428
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/11/2022 1:53:43 PM
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Identificators

InChI InChI=1S/C16H21N5O3/c22-15-12(19-9-14-17-6-7-18-14)10-24-13(15)8-20-16(23)21-11-4-2-1-3-5-11/h1-7,12-13,15,19,22H,8-10H2,(H,17,18)(H2,20,21,23)/t12-,13-,15+/m1/s1
InChI Key XVXXSCAEQATGNN-NFAWXSAZSA-N
Canonical SMILES C1C(C(C(O1)CNC(=O)NC2=CC=CC=C2)O)NCC3=NC=CN3
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(1H-imidazol-2-ylmethyl)amino]-5-[[(phenylamino)carbonyl]amino]-;
NAT19-551933

In Other Databases

PubChem 75536779
ChemSpider 29858705