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Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > salt > organic salt > organic sodium salt > sodium 2-acetamido-2-deoxy-3-o-(6-o-sulfonato-beta-d-glucosyl)-beta-d-galactose
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > salt > alkali metal salt > sodium salt > organic sodium salt > sodium 2-acetamido-2-deoxy-3-o-(6-o-sulfonato-beta-d-glucosyl)-beta-d-galactose

Preferred term

sodium 2-acetamido-2-deoxy-3-o-(6-o-sulfonato-beta-d-glucosyl)-beta-d-galactose  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C14H24NNaO14S

inchi

  • InChI=1S/C14H25NO14S.Na/c1-4(17)15-7-12(9(19)5(2-16)27-13(7)22)29-14-11(21)10(20)8(18)6(28-14)3-26-30(23,24)25;/h5-14,16,18-22H,2-3H2,1H3,(H,15,17)(H,23,24,25);/q;+1/p-1/t5-,6-,7-,8-,9-,10+,11-,12-,13-,14+;/m1./s1

inchikey

  • YODWMXAQPLYMJP-CZTWLNPSSA-M

mass

  • 485.39300

monoisotopicmass

  • 485.08152

smiles

  • [Na+].CC(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@@H]1O[C@H](COS([O-])(=O)=O)[C@@H](O)[C@H](O)[C@H]1O

subset

  • 3_STAR

synonym EXACT

  • sodium 6-O-sulfonato-beta-D-glucopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranose

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:61039

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