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6-deoxy-6-sulfo-D-gluconate

PropertiesImage
MNX_IDMNXM162460 Image of MNXM162460
referencechebi:88093
formulaC6H10O9S
global charge-2
mol weight258.204
InChIKeySBCIXDBITAKZCS-SQOUGZDYSA-L
InChIInChI=1S/C6H12O9S/c7-2(1-16(13,14)15)3(8)4(9)5(10)6(11)12/h2-5,7-10H,1H2,(H,11,12)(H,13,14,15)/p-2/t2-,3-,4+,5-/m1/s1
SMILESO=C([O-])[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CS(=O)(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C6H12O9S/c7-2(1-16(13,14)15)3(8)4(9)5(10)6(11)12/h2-5,7-10H,1H2,(H,11,12)(H,13,14,15)/t2-,3-,4+,5-/m1/s1 Image of MNXM162460
SMILES (mnx)[CH2:1]([C@H:2]([C@H:3]([C@@H:4]([C@H:5]([C:6](=[O:11])[OH:12])[OH:10])[OH:9])[OH:8])[OH:7])[S:16]([OH:13])(=[O:14])=[O:15]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:88093
chebi:88093
SBCIXDBITAKZCS-SQOUGZDYSA-L
6-deoxy-6-sulfo-D-gluconate
6-deoxy-6-sulfo-D-gluconate(2-)
6-deoxy-6-sulfonato-D-gluconate
6-deoxy-D-gluconate 6-sulfonate

kegg.compound:C21182
keggC:C21182
SBCIXDBITAKZCS-SQOUGZDYSA-N
6-Deoxy-6-sulfo-D-gluconate
6-Deoxy-6-sulfogluconate

metacyc.compound:CPD-18482
metacycM:CPD-18482
seed.compound:cpd32386
seedM:cpd32386
SBCIXDBITAKZCS-SQOUGZDYSA-L
6-deoxy-6-sulfo-D-gluconate
6-deoxy-D-gluconate 6-sulfonate

CHEBI:88270
chebi:88270
SBCIXDBITAKZCS-SQOUGZDYSA-N
6-deoxy-6-sulfo-D-gluconic acid
6-deoxy-6-sulfogluconic acid
6-deoxy-D-gluconic acid 6-sulfonate

keggC:M_C21182
seedM:M_cpd32386
secondary/obsolete/fantasy identifier