Record Information
Version2.0
StatusDetected and Quantified
Creation Date2022-06-17 19:45:50 UTC
Update Date2025-10-07 16:08:59 UTC
Metabolite IDMMDBc0055190
Metabolite Identification
Common Name1D-myo-inositol 2-(L-cysteinylamino)-2-deoxy-alpha-D-glucopyranoside
Description1D-myo-inositol 2-(L-cysteinylamino)-2-deoxy-alpha-D-glucopyranoside is a glycoside compound belonging to the class of amino sugar derivatives. There is limited literature available on this metabolite, indicating that further research may be needed to fully understand its biological significance and potential applications.
Structure
Synonyms
ValueSource
1D-Myo-inositol 2-(L-cysteinylamino)-2-deoxy-alpha-D-glucopyranosideChEBI
1D-Myo-inositol 2-(L-cysteinylamino)-2-deoxy-a-D-glucopyranosideGenerator
1D-Myo-inositol 2-(L-cysteinylamino)-2-deoxy-α-D-glucopyranosideGenerator
1D-Myo-inositol 2-(L-cysteiniumylamino)-2-deoxy-a-D-glucopyranosideGenerator
1D-Myo-inositol 2-(L-cysteiniumylamino)-2-deoxy-α-D-glucopyranosideGenerator
Molecular FormulaC15H29N2O11S
Average Mass445.46
Monoisotopic Mass445.148657356
IUPAC Name(1R)-1-{[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}oxan-3-yl]-C-hydroxycarbonimidoyl}-2-sulfanylethan-1-aminium
Traditional Name(1R)-1-{[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}oxan-3-yl]-C-hydroxycarbonimidoyl}-2-sulfanylethanaminium
CAS Registry NumberNot Available
SMILES
[H][C@]([NH3+])(CS)C(O)=N[C@@]1([H])[C@@]([H])(O[C@@]2([H])[C@]([H])(O)[C@@]([H])(O)[C@]([H])(O)[C@@]([H])(O)[C@@]2([H])O)O[C@]([H])(CO)[C@@]([H])(O)[C@]1([H])O
InChI Identifier
InChI=1S/C15H28N2O11S/c16-3(2-29)14(26)17-5-7(20)6(19)4(1-18)27-15(5)28-13-11(24)9(22)8(21)10(23)12(13)25/h3-13,15,18-25,29H,1-2,16H2,(H,17,26)/p+1/t3-,4+,5+,6+,7+,8-,9-,10+,11+,12+,13-,15+/m0/s1
InChI KeyZGXSCMBZZVXWGF-BSEFFJTHSA-O