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Biological Magnetic Resonance Data BankA Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules |
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(D)-XYLOSE; (+)-Xylose; D-Xylose; Xylose; Xylo-Pfan; 2,3,4,5-Tetrahydroxypentanal; Xylose, pure; Xylose, D-; Xylose (VAN); Wood sugar
Molecular Formula: C5 H10 O5
Natural Isotopic Abundance Mass: 150.1299000000
Mono-Isotopic Molecular Masses:
InChI String: InChI=1S/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2/t2-,3+,4-,5+/m1/s1
isomeric SMILES: C1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O)O
canonical SMILES: C1C(C(C(C(O1)O)O)O)O
IUPAC: IUPAC systematic
(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol
IUPAC traditional: IUPAC cas: IUPAC openeye
(2S,3R,4S,5R)-tetrahydropyran-2,3,4,5-tetrol
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
Atom numbering calculated using ALATIS. Citation: Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773