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Concept information

... > chemical entity > molecular entity > ion > anion > organic anion > organophosphate oxoanion > n-acetyl-alpha-d-galactosaminyl-(1->3)-n,n'-diacetyl-alpha-d-bacillosaminyl-tritrans,heptacis-undecaprenyl diphosphate(2-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > organophosphate oxoanion > n-acetyl-alpha-d-galactosaminyl-(1->3)-n,n'-diacetyl-alpha-d-bacillosaminyl-tritrans,heptacis-undecaprenyl diphosphate(2-)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic anion > organophosphate oxoanion > n-acetyl-alpha-d-galactosaminyl-(1->3)-n,n'-diacetyl-alpha-d-bacillosaminyl-tritrans,heptacis-undecaprenyl diphosphate(2-)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > phosphorus molecular entity > phosphorus oxoacids and derivatives > phosphorus oxoacid derivative > phosphoric acid derivative > organophosphate oxoanion > n-acetyl-alpha-d-galactosaminyl-(1->3)-n,n'-diacetyl-alpha-d-bacillosaminyl-tritrans,heptacis-undecaprenyl diphosphate(2-)
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > phosphorus oxoacid derivative > phosphoric acid derivative > organophosphate oxoanion > n-acetyl-alpha-d-galactosaminyl-(1->3)-n,n'-diacetyl-alpha-d-bacillosaminyl-tritrans,heptacis-undecaprenyl diphosphate(2-)

Preferred term

n-acetyl-alpha-d-galactosaminyl-(1->3)-n,n'-diacetyl-alpha-d-bacillosaminyl-tritrans,heptacis-undecaprenyl diphosphate(2-)  

Type

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

Broader concept

charge

  • -2

formula

  • C73H119N3O16P2

inchi

  • InChI=1S/C73H121N3O16P2/c1-50(2)27-17-28-51(3)29-18-30-52(4)31-19-32-53(5)33-20-34-54(6)35-21-36-55(7)37-22-38-56(8)39-23-40-57(9)41-24-42-58(10)43-25-44-59(11)45-26-46-60(12)47-48-87-93(83,84)92-94(85,86)91-73-68(76-64(16)80)71(66(61(13)88-73)74-62(14)78)90-72-67(75-63(15)79)70(82)69(81)65(49-77)89-72/h27,29,31,33,35,37,39,41,43,45,47,61,65-73,77,81-82H,17-26,28,30,32,34,36,38,40,42,44,46,48-49H2,1-16H3,(H,74,78)(H,75,79)(H,76,80)(H,83,84)(H,85,86)/p-2/b51-29+,52-31+,53-33+,54-35-,55-37-,56-39-,57-41-,58-43-,59-45-,60-47-/t61-,65-,66-,67-,68-,69+,70-,71+,72-,73-/m1/s1

inchikey

  • XKBQJSBUHZIVDD-SKYXNNIUSA-L

is_conjugate_base_of

mass

  • 1356.68400

monoisotopicmass

  • 1355.80766

smiles

  • C[C@H]1O[C@H](OP([O-])(=O)OP([O-])(=O)OC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CCC=C(C)C)[C@H](NC(C)=O)[C@@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)[C@@H]1NC(C)=O

subset

  • 3_STAR

synonym EXACT

  • 2,4-diacetamido-3-O-(2-acetamido-2-deoxy-alpha-D-galactopyranosyl)-2,4,6-trideoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-glucopyranose

synonym RELATED

  • alpha-D-GalNAc-(1->3)-alpha-D-diNAcBac-tritrans,heptacis-undecaprenyl diphosphate
  • alpha-D-GalNAc-(1->3)-alpha-D-diNAcBac-tritrans,heptacis-undecaprenyl diphosphate(2-)
  • N-acetyl-alpha-D-galactosaminyl-(1->3)-N,N'-diacetyl-alpha-D-bacillosaminyl-tri-trans,hepta-cis-undecaprenyl diphosphate
  • N-acetyl-alpha-D-galactosaminyl-(1->3)-N,N'-diacetyl-alpha-D-bacillosaminyl-tritrans,heptacis-undecaprenyl diphosphate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68652

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