5-Amino-4-(diazoacetyl)-1-ribofuranosylimidazole
Basic information
- CAS
105400-24-6- Standard SMILES
[N-]=[N+]=CC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1N- InChIKey
QMJMFPVSSVJEOX-WCZIJUJWSA-O- Molecular formula
- C10H13N5O5
- Average molar mass
- 283.24 g/mol
- Monoisotopic mass
- 283.09166853
Overview
RN & structure given in first source; RN not in Chemline 3/87
Names & identifiers
- Preferred name
- 5-Amino-4-(diazoacetyl)-1-ribofuranosylimidazole
- IUPAC
- 1-[5-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]-2-diazoethanone
- English name
- (Z)-1-[5-amino-1-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan- 2-yl]imidazol-4-yl]-2-diazonio-ethenolate
- Molecular formula
- C10H13N5O5
- Molecular weight
- 0
Names & synonyms
5-Adrfi105400-24-65-Amino-4-(diazoacetyl)-1-ribofuranosylimidazoleRefChem:101958(Z)-1-[5-amino-1-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan- 2-yl]imidazol-4-yl]-2-diazoni1-[5-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]-2-diazoethanoneEthanone, 1-(5-amino-1-beta-D-ribofuranosyl-1H-imidazol-4-yl)-2-diazo-5-amino-4-(diazoacetyl)-1-β-D-ribofuranosylimidazole(Z)-1-[5-amino-1-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan- 2-yl]imidazol-4-yl]-2-diazonio-ethenolate
Database identifiers
- CAS
105400-24-6- PubChem CID
- 128359
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 428
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Related reactions
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Compound notes
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