L-Iditol

Systematic / IUPAC Name: (2S,3R,4R,5S)-Hexane-1,2,3,4,5,6-hexol

ID: Reference2573

Other Names: Cordycepic acid;
Iso-sorbide;
Isotol;
Hexahydroxyhexane

Formula: C6H14O6

Class: Endogenous Metabolites

Spectral Data

L-Iditol 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 Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 212
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/16/2016 12:13:39 PM
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Identificators

InChI InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4-,5+,6+/m0/s1
InChI Key FBPFZTCFMRRESA-UNTFVMJOSA-N
Canonical SMILES C(C(C(C(C(CO)O)O)O)O)O
CAS 488459
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Other Names Cordycepic acid;
Iso-sorbide;
Isotol;
Hexahydroxyhexane

In Other Databases

PubChem 5460044
Wikipedia Iditol
ChemSpider 4573729
KEGG C01507
HMDb HMDB11632
ChEBI CHEBI:18202