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Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > salt > organic salt > organic sodium salt > trisodium 4-o-[4-o-(2-acetamido-2-deoxy-alpha-d-glucosylphospho)-2-acetamido-2-deoxy-alpha-d-glucosylphospho]-2-acetamido-2-deoxy-alpha-d-glucosyl 3-aminopropyl phosphate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > salt > alkali metal salt > sodium salt > organic sodium salt > trisodium 4-o-[4-o-(2-acetamido-2-deoxy-alpha-d-glucosylphospho)-2-acetamido-2-deoxy-alpha-d-glucosylphospho]-2-acetamido-2-deoxy-alpha-d-glucosyl 3-aminopropyl phosphate

Preferred term

trisodium 4-o-[4-o-(2-acetamido-2-deoxy-alpha-d-glucosylphospho)-2-acetamido-2-deoxy-alpha-d-glucosylphospho]-2-acetamido-2-deoxy-alpha-d-glucosyl 3-aminopropyl phosphate  

Type

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

Broader concept

charge

  • 0

formula

  • C27H48N4Na3O25P3

inchi

  • InChI=1S/C27H51N4O25P3.3Na/c1-10(35)29-16-20(39)19(38)13(7-32)49-25(16)55-58(44,45)52-24-15(9-34)51-27(18(22(24)41)31-12(3)37)56-59(46,47)53-23-14(8-33)50-26(17(21(23)40)30-11(2)36)54-57(42,43)48-6-4-5-28;;;/h13-27,32-34,38-41H,4-9,28H2,1-3H3,(H,29,35)(H,30,36)(H,31,37)(H,42,43)(H,44,45)(H,46,47);;;/q;3*+1/p-3/t13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-;;;/m1.../s1

inchikey

  • CQJDOGABBLWOSH-NBBXRHNTSA-K

mass

  • 990.57240

monoisotopicmass

  • 990.15136

smiles

  • [Na+].[Na+].[Na+].CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1OP([O-])(=O)O[C@H]1[C@H](O)[C@@H](NC(C)=O)[C@@H](OP([O-])(=O)O[C@H]2[C@H](O)[C@@H](NC(C)=O)[C@@H](OP([O-])(=O)OCCCN)O[C@@H]2CO)O[C@@H]1CO

subset

  • 3_STAR

synonym EXACT

  • trisodium 4-O-[4-O-(2-acetamido-2-deoxy-alpha-D-glucopyranosylphospho)-2-acetamido-2-deoxy-alpha-D-glucopyranosylphospho]-2-acetamido-2-deoxy-alpha-D-glucopyranosyl 3-aminopropyl phosphate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:84564

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