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4-(hydroxymethyl)benzenesulfonate

Properties

Image

Occurences in reactions

MNX_ID

MNXM3180

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₇H₇O₄S

charge

-1

mass

187.00705

reference

InChIKey

VVQVMHASNBSOOC-UHFFFAOYSA-M

InChI

InChI=1S/C7H8O4S/c8-5-6-1-3-7(4-2-6)12(9,10)11/h1-4,8H,5H2,(H,9,10,11)/p-1

SMILES

O=S(=O)([O-])c1ccc(CO)cc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:11944 chebi:11944	4-(hydroxymethyl)benzenesulfonate
CHEBI:18312 chebi:18312	4-(hydroxymethyl)benzenesulfonic acid 4-(Hydroxymethyl)benzenesulfonate 4-Sulfobenzyl alcohol
envipath:...01cfd906d3ba envipathM:...01cfd906d3ba	4-Sulfobenzyl alcohol
kegg.compound:C06678 keggC:C06678	4-Sulfobenzyl alcohol 4-(Hydroxymethyl)benzenesulfonate
seed.compound:cpd04079 seedM:cpd04079	4-Sulfobenzyl alcohol 4-(Hydroxymethyl)benzenesulfonate 4-sulfobenzyl alcohol 4-sulphobenzyl alcohol p-sulfobenzyl alcohol
metacyc.compound:4-SULFOBENZYL-ALCOHOL metacycM:4-SULFOBENZYL-ALCOHOL	4-sulfobenzyl alcohol 4-(Hydroxymethyl)benzenesulfonate 4-sulphobenzyl alcohol p-sulfobenzyl alcohol
envipath:...f05ebbc21ff2 envipathM:...f05ebbc21ff2	compound 0060010
chebi:1937 chebi:20298 keggC:M_C06678 seedM:M_cpd04079	secondary/obsolete/fantasy identifier