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4-O-beta-D-glucopyranosyl-D-gluconate

Properties Image Occurences in reactions MNX_ID MNXM1231118 #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 1 formula C12H21O12 charge -1 mass 357.288 reference chebi:76825 InChIKey JYTUSYBCFIZPBE-ZNLUKOTNSA-M InChI InChI=1S/C12H22O12/c13-1-3(15)10(7(18)8(19)11(21)22)24-12-9(20)6(17)5(16)4(2-14)23-12/h3-10,12-20H,1-2H2,(H,21,22)/p-1/t3-,4-,5-,6+,7-,8-,9-,10-,12+/m1/s1 SMILES [CH2:1]([C@H:3]([C@H:10]([C@@H:7]([C@H:8]([C:11](=[O:21])[OH:22])[OH:19])[OH:18])[O:24][C@H:12]1[C@H:9]([OH:20])[C@@H:6]([OH:17])[C@H:5]([OH:16])[C@@H:4]([CH2:2][OH:14])[O:23]1)[OH:15])[OH:13]

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Similar chemical compounds in external resources

Identifier	Description
CHEBI:76825 chebi:76825	4-O-beta-D-glucopyranosyl-D-gluconate 4-O-beta-D-glucosyl-D-gluconate beta-D-glucopyranosyl-(1->4)-D-gluconate beta-D-glucosyl-(1->4)-D-gluconate cellobionate
seed.compound:cpd32790 seedM:cpd32790	4-O-beta-D-glucopyranosyl-D-gluconate cellobionate cellobionic acid
kegg.compound:C20888 keggC:C20888	Cellobionate 4-O-beta-D-Glucopyranosyl-D-gluconate Cellobionic acid
sabiork.compound:29866 sabiorkM:29866	Cellobionic acid 4-O-beta-D-Glucopyranosyl-D-gluconate
metacyc.compound:CPD-25263 metacycM:CPD-25263	D-maltobionate 4-O-(alpha-D-glucosyl)-D-gluconate
hmdb:HMDB0253945	Lactobionic acid 2,3,5,6-tetrahydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexanoic acid Maltobionate
metacyc.compound:CPD-16182 metacycM:CPD-16182	cellobionate 4-O-beta-D-glucopyranosyl-D-gluconate cellobionic acid
CHEBI:77021 chebi:77021	cellobionic acid 4-O-beta-D-glucopyranosyl-D-gluconic acid 4-O-beta-D-glucosyl-D-gluconic acid Maltobionic acid beta-D-glucopyranosyl-(1->4)-D-gluconic acid beta-D-glucosyl-(1->4)-D-gluconic acid
envipath:...3d405cca2ca4 envipathM:...3d405cca2ca4	compound 0280992
metacyc.compound:CPD-25262 metacycM:CPD-25262	lactobionate 4-O-beta-D-galactopyranosyl-D-gluconate lactobionic acid
keggC:M_C20888 seedM:M_cpd32790	secondary/obsolete/fantasy identifier