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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > disaccharide derivative > 2-n-acetyl-alpha-d-glucosaminopyranosyl-(1->3)-2-n-acetyl-6-(5-aminopentyl phosphoryl)-alpha-d-glucosaminopyranosyl-(1->2)-(2r)-3-hydroxypropanoate dimer
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > disaccharide derivative > 2-n-acetyl-alpha-d-glucosaminopyranosyl-(1->3)-2-n-acetyl-6-(5-aminopentyl phosphoryl)-alpha-d-glucosaminopyranosyl-(1->2)-(2r)-3-hydroxypropanoate dimer
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > disaccharide derivative > 2-n-acetyl-alpha-d-glucosaminopyranosyl-(1->3)-2-n-acetyl-6-(5-aminopentyl phosphoryl)-alpha-d-glucosaminopyranosyl-(1->2)-(2r)-3-hydroxypropanoate dimer

Preferred term

2-n-acetyl-alpha-d-glucosaminopyranosyl-(1->3)-2-n-acetyl-6-(5-aminopentyl phosphoryl)-alpha-d-glucosaminopyranosyl-(1->2)-(2r)-3-hydroxypropanoate dimer  

Type

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

Broader concept

charge

  • 0

formula

  • C39H69N3O33P2

inchi

  • InChI=1S/C39H69N3O33P2/c1-14(46)41-22-28(52)24(48)16(8-43)68-36(22)74-32-27(51)21(73-38(30(32)54)69-17(9-44)34(56)57)13-67-77(62,63)66-11-19-25(49)29(53)23(42-15(2)47)37(71-19)75-33-26(50)20(12-65-76(60,61)64-7-5-3-4-6-40)72-39(31(33)55)70-18(10-45)35(58)59/h16-33,36-39,43-45,48-55H,3-13,40H2,1-2H3,(H,41,46)(H,42,47)(H,56,57)(H,58,59)(H,60,61)(H,62,63)/t16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32+,33+,36-,37-,38+,39+/m1/s1

inchikey

  • XCBIIXMNTTXMSM-VKJCAURSSA-N

mass

  • 1169.91300

monoisotopicmass

  • 1169.32886

smiles

  • CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1O[C@H]1[C@H](O)[C@@H](COP(O)(=O)OC[C@H]2O[C@H](O[C@H]3[C@H](O)[C@@H](COP(O)(=O)OCCCCCN)O[C@H](O[C@H](CO)C(O)=O)[C@@H]3O)[C@H](NC(C)=O)[C@@H](O)[C@@H]2O)O[C@H](O[C@H](CO)C(O)=O)[C@@H]1O

subset

  • 3_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:74980

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