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Pyrogallol-1-O-sulphate

PropertiesImage
MNX_IDMNXM160701 Image of MNXM160701
referencechebi:89613
formulaC6H6O6S
global charge0
mol weight206.175
InChIKeyNGVLEQPKHLWZLN-UHFFFAOYSA-N
InChIInChI=1S/C6H6O6S/c7-4-2-1-3-5(6(4)8)12-13(9,10)11/h1-3,7-8H,(H,9,10,11)
SMILESO=S(=O)(O)OC1=C(O)C(O)=CC=C1
MNX internals
InChI (mnx)InChI=1/C6H6O6S/c7-4-2-1-3-5(6(4)8)12-13(9,10)11/h1-3,7-8H,(H,9,10,11) Image of MNXM160701
SMILES (mnx)[CH:1]1=[CH:2][C:4]([OH:7])=[C:6]([OH:8])[C:5]([O:12][S:13]([OH:9])(=[O:10])=[O:11])=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:89613
chebi:89613
NGVLEQPKHLWZLN-UHFFFAOYSA-N 		Pyrogallol-1-O-sulphate
(2,3-dihydroxyphenyl) hydrogen sulfate
(2,3-dihydroxyphenyl) hydrogen sulphate
(2,3-dihydroxyphenyl)oxidanesulfonic acid
hmdb:HMDB0060016
NGVLEQPKHLWZLN-UHFFFAOYSA-N 		Pyrogallol-1-O-sulphate
(2,3-Dihydroxyphenyl)oxidanesulfonate
(2,3-Dihydroxyphenyl)oxidanesulphonate
(2,3-Dihydroxyphenyl)oxidanesulphonic acid
(2,3-dihydroxyphenyl)oxidanesulfonic acid
Pyrogallol-1-O-sulfate
Pyrogallol-1-O-sulfuric acid
Pyrogallol-1-O-sulphuric acid

hmdb:HMDB60016 		secondary/obsolete/fantasy identifier