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Chemistry, part 1

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Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > carbohydrate acid derivative > glucosiduronic acid > (2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(2r,3r,4r,5r,6s)-6-hydroxy-2-(hydroxymethyl)-5-(sulfoamino)-4-sulfooxyoxan-3-yl]oxyoxane-2-carboxylic acid
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > glycosiduronic acid > glucosiduronic acid > (2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(2r,3r,4r,5r,6s)-6-hydroxy-2-(hydroxymethyl)-5-(sulfoamino)-4-sulfooxyoxan-3-yl]oxyoxane-2-carboxylic acid

Preferred term

(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(2r,3r,4r,5r,6s)-6-hydroxy-2-(hydroxymethyl)-5-(sulfoamino)-4-sulfooxyoxan-3-yl]oxyoxane-2-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C12H21NO17S2

inchi

  • InChI=1S/C12H21NO17S2/c14-1-2-7(28-12-6(17)4(15)5(16)9(29-12)10(18)19)8(30-32(24,25)26)3(11(20)27-2)13-31(21,22)23/h2-9,11-17,20H,1H2,(H,18,19)(H,21,22,23)(H,24,25,26)/t2-,3-,4+,5+,6-,7-,8-,9-,11+,12-/m1/s1

inchikey

  • WLFJZMYYKJMMJM-UVTRRXGKSA-N

mass

  • 515.410

monoisotopicmass

  • 515.02509

smiles

  • S(O)(=O)(=O)N[C@@H]1[C@@H](OS(O)(=O)=O)[C@H](O[C@@H]2O[C@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)[C@H](O[C@@H]1O)CO

subset

  • 2_STAR

synonym RELATED

  • alpha-L-ido-hexopyranosyluronic acid-(1->4)-2-deoxy-3-O-sulfo-2-sulfoamino-alpha-D-gluco-hexopyranose
  • IdoA(a1-4)a-GlcNS3S
  • WURCS=2.0/2,2,1/[a2122h-1a_1-5_2*NSO/3=O/3=O_3*OSO/3=O/3=O][a2121A-1a_1-5]/1-2/a4-b1

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:151538

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