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Concept information

Preferred term

HP_dp02_0009  

Type

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

charge

  • 0

formula

  • C12H19NO19S3

inchi

  • InChI=1S/C12H19NO19S3/c14-3-1-4(10(16)17)30-12(8(3)32-35(25,26)27)31-9-5(2-28-34(22,23)24)29-11(18)6(7(9)15)13-33(19,20)21/h1,3,5-9,11-15,18H,2H2,(H,16,17)(H,19,20,21)(H,22,23,24)(H,25,26,27)/t3-,5+,6+,7+,8+,9+,11-,12-/m0/s1

inchikey

  • LRPGJWKAYQRIAQ-GYBHJADLSA-N

mass

  • 577.473

monoisotopicmass

  • 576.97134

smiles

  • O(S(O)(=O)=O)[C@H]1[C@@H](OC(=C[C@@H]1O)C(=O)O)O[C@H]2[C@@H]([C@H]([C@H](O[C@@H]2COS(O)(=O)=O)O)NS(O)(=O)=O)O

subset

  • 3_STAR

synonym EXACT

  • 2-deoxy-4-O-(4-deoxy-2-O-sulfo-alpha-L-threo-hex-4-enopyranuronosyl)-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranose

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:138683

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