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4-(4-Deoxy-alpha-D-gluc-4-enuronosyl)-D-galacturonate

Properties

Image

Occurences in reactions

MNX_ID

MNXM2081

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

formula

C₁₂H₁₆O₁₂

charge

mass

352.06418

reference

keggC:C06118

InChIKey

LLVVMXFNKAHVEZ-KMBKDFKYSA-N

InChI

InChI=1S/C12H16O12/c13-2-1-3(9(17)18)22-12(4(2)14)24-7-5(15)6(16)11(21)23-8(7)10(19)20/h1-2,4-8,11-16,21H,(H,17,18)(H,19,20)/t2-,4+,5+,6+,7+,8-,11+,12+/m0/s1

SMILES

O=C(O)C1=C[C@H](O)[C@@H](O)[C@@H](O[C@H]2[C@@H](C(=O)O)O[C@@H](O)[C@H](O)[C@H]2O)O1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
kegg.compound:C06118 keggC:C06118	4-(4-Deoxy-alpha-D-gluc-4-enuronosyl)-D-galacturonate 4-(4-Deoxy-alpha-D-galact-4-enuronosyl)-D-galacturonate Unsaturated digalacturonate
seed.compound:cpd03648 seedM:cpd03648	4-(4-Deoxy-alpha-D-gluc-4-enuronosyl)-D-galacturonate 4-(4-Deoxy-alpha-D-galact-4-enuronosyl)-D-galacturonate 4-(4-deoxy-alpha-D-galact-4-enuronosyl)-D-galacturonate 4-(4-deoxy-alpha-D-gluc-4-enosyluronic acid)-D-galacturonic acid 4-(4-deoxy-alpha-D-gluc-4-enuronosyl)-D-galacturonate 4-O-(4-deoxy-beta-L-threo-hex-4-enopyranosyluronic acid)-D-galactopyranuronic acid Unsaturated digalacturonate unsaturated digalacturonate
CHEBI:60189 chebi:60189	4-(4-deoxy-alpha-D-galact-4-enuronosyl)-D-galacturonate 4-(4-deoxy-alpha-D-galact-4-enosyluronic acid)-D-galacturonate dianion 4-(4-deoxy-alpha-D-galact-4-enosyluronic acid)-D-galacturonate(2-) 4-(4-deoxy-alpha-D-galact-4-enuronosyl)-D-galacturonate dianion 4-(4-deoxy-alpha-D-galact-4-enuronosyl)-D-galacturonate(2-) 4-(4-deoxy-alpha-D-gluc-4-enosyluronic acid)-D-galacturonate dianion 4-(4-deoxy-alpha-D-gluc-4-enosyluronic acid)-D-galacturonate(2-) 4-O-(4-deoxy-beta-L-threo-hex-4-enopyranuronosyl)-D-galactopyranuronate
metacyc.compound:CPD-11241 metacycM:CPD-11241	4-(4-deoxy-alpha-D-galact-4-enuronosyl)-D-galacturonate 4-(4-deoxy-alpha-D-gluc-4-enosyluronic acid)-D-galacturonic acid 4-(4-deoxy-alpha-D-gluc-4-enuronosyl)-D-galacturonate 4-(4-deoxy-beta-D-gluc-4-enuronosyl)-D-galacturonate 4-(4-deoxy-beta-D-gluc-4-enuronosyl)-galacturonate 4-O-(4-deoxy-beta-L-threo-hex-4-enopyranosyluronic acid)-D-galactopyranuronic acid unsaturated digalacturonate
CHEBI:27450 chebi:27450	4-(4-deoxy-alpha-D-gluc-4-enosyluronic acid)-D-galacturonic acid 4-(4-Deoxy-alpha-D-galact-4-enuronosyl)-D-galacturonate 4-(4-Deoxy-alpha-D-gluc-4-enuronosyl)-D-galacturonate 4-(4-deoxy-alpha-D-galact-4-enosyluronic acid)-D-galacturonic acid 4-O-(4-deoxy-beta-L-threo-hex-4-enopyranosyluronic acid)-D-galactopyranuronic acid Unsaturated digalacturonate
kegg.glycan:G10113 keggG:G10113	G10113
chebi:1767 chebi:1769 chebi:20289 chebi:20290 chebi:28551 keggC:M_C06118 keggG:M_G10113 seedM:M_cpd03648	secondary/obsolete/fantasy identifier