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3,4-dihydroxymandelate

Properties

Image

Occurences in reactions

MNX_ID

MNXM3473

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	7

formula

C₈H₇O₅

charge

-1

mass

183.0299

reference

metacycM:CPD-11879

InChIKey

RGHMISIYKIHAJW-SSDOTTSWSA-M

InChI

InChI=1S/C8H8O5/c9-5-2-1-4(3-6(5)10)7(11)8(12)13/h1-3,7,9-11H,(H,12,13)/p-1/t7-/m1/s1

SMILES

O=C([O-])[C@H](O)c1ccc(O)c(O)c1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD-11879 metacycM:CPD-11879	3,4-dihydroxymandelate 3,4-dihydroxymandelic acid DHMA dihydroxymandelic acid mandelic acid, 3,4-dihydroxy-
bigg.metabolite:34dhoxmand biggM:34dhoxmand	3,4-Dihydroxymandelate
kegg.compound:C05580 keggC:C05580	3,4-Dihydroxymandelate 3,4-Dihydroxymandelic acid Dihydroxymandelic acid
hmdb:HMDB0001866	3,4-Dihydroxymandelic acid (3,4-Dihydroxyphenyl)(hydroxy)acetate (3,4-Dihydroxyphenyl)(hydroxy)acetic acid 2-(3,4-dihydroxyphenyl)-2-hydroxyacetic acid 3,4 Dihydroxymandelate 3,4 Dihydroxymandelic acid 3,4-Dihydroxymandelate 3,4-Dihydroxymandelic acid, (+-)-isomer 3,4-Dihydroxymandelic acid, (S)-isomer 3,4-Dihydroxymandelic acid, ion(1-) 3,4-Dihydroxymandelic acid, monosodium salt 3,4-Dihydroxyphenylglycolate 3,4-Dihydroxyphenylglycolic acid DHMA DOMA Dihydroxymandelate Dihydroxymandelic acid dihydroxymandelic acid
sabiork.compound:26612 sabiorkM:26612	3,4-Dihydroxyphenylglycolate (3,4-Dihydroxyphenyl)(hydroxy)acetate
CHEBI:53326 chebi:53326	3,4-dihydroxymandelate (3,4-dihydroxyphenyl)(hydroxy)acetate 2-(3,4-dihydroxyphenyl)-2-hydroxyacetate
CHEBI:27637 chebi:27637	3,4-dihydroxymandelic acid (3,4-dihydroxyphenyl)(hydroxy)acetic acid 2-(3,4-dihydroxyphenyl)-2-hydroxyacetic acid 3,4-Dihydroxymandelate 3,4-Dihydroxymandelic acid 3,4-Dihydroxyphenylglycolic acid DOMA Dihydroxymandelic acid
seed.compound:cpd03310 seedM:cpd03310	Dihydroxymandelic acid 3,4-Dihydroxymandelate 3,4-Dihydroxymandelic acid 3,4-dihydroxymandelate 3,4-dihydroxymandelic acid DHMA dihydroxymandelic acid mandelic acid, 3,4-dihydroxy-
envipath:...d5790e05f0d6 envipathM:...d5790e05f0d6	compound 0001288
envipath:...c12069a3745d envipathM:...c12069a3745d	compound 0060573
hmdb:HMDB01866 chebi:1383 chebi:19884 biggM:M_34dhoxmand keggC:M_C05580 seedM:M_cpd03310	secondary/obsolete/fantasy identifier