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5-Amino-1-(2,3,5-tri-O-acetyl-.beta.,D-ribofuranosyl)imidazole-4-carboxylic acid
SpectraBase Compound ID 6PoEYWkutl8
InChI InChI=1S/C15H19N3O9/c1-6(19)24-4-9-11(25-7(2)20)12(26-8(3)21)14(27-9)18-5-17-10(13(18)16)15(22)23/h5,9,11-12,14H,4,16H2,1-3H3,(H,22,23)/t9-,11+,12-,14+/m1/s1
InChIKey QLRMAZFNEAAGMK-LEKOTGGOSA-N
Mol Weight 385.33 g/mol
Molecular Formula C15H19N3O9
Exact Mass 385.112129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RMA3fm9maF
Name 5-Amino-1-(2,3,5-tri-O-acetyl-.beta.,D-ribofuranosyl)imidazole-4-carboxylic acid
Alternate Name(s) 5-amino-1-[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)-2-oxolanyl]-4-imidazolecarboxylic acid 5-amino-1-[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]imidazole-4-carboxylic acid 5-azanyl-1-[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]imidazole-4-carboxylic acid
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19N3O9
InChI InChI=1S/C15H19N3O9/c1-6(19)24-4-9-11(25-7(2)20)12(26-8(3)21)14(27-9)18-5-17-10(13(18)16)15(22)23/h5,9,11-12,14H,4,16H2,1-3H3,(H,22,23)/t9-,11+,12-,14+/m1/s1
InChIKey QLRMAZFNEAAGMK-LEKOTGGOSA-N
Molecular Weight 385.329 g/mol
SMILES OC(c1nc[n](c1N)[C@@]1([C@@]([C@@](OC(=O)C)([C@](O1)(COC(=O)C)[H])[H])(OC(=O)C)[H])[H])=O
SPLASH splash10-052f-9040000000-196694ef973b5955ae18
Source of Spectrum KC-0-2864-2
Wiley ID 782441