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Concept information

organooxygen compound > ester > phosphoric ester > phosphocholines > n-acetyl-d-galactosamine-6-phosphocholine
... > chemical entity > molecular entity > ion > cation > organic cation > quaternary ammonium ion > cholines > phosphocholines > n-acetyl-d-galactosamine-6-phosphocholine
organooxygen compound > ester > choline ester > phosphocholines > n-acetyl-d-galactosamine-6-phosphocholine

Preferred term

n-acetyl-d-galactosamine-6-phosphocholine  

Type

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

charge

  • +1

formula

  • C13H28N2O9P

has_functional_parent

inchi

  • InChI=1S/C13H27N2O9P/c1-8(16)14-10-12(18)11(17)9(24-13(10)19)7-23-25(20,21)22-6-5-15(2,3)4/h9-13,17-19H,5-7H2,1-4H3,(H-,14,16,20,21)/p+1/t9-,10-,11+,12-,13?/m1/s1

inchikey

  • VGSHXNQBJVLXRV-HENWMNBSSA-O

mass

  • 387.34320

monoisotopicmass

  • 387.15269

smiles

  • CC(=O)N[C@H]1C(O)O[C@H](COP(O)(=O)OCC[N+](C)(C)C)[C@H](O)[C@@H]1O

subset

  • 3_STAR

synonym EXACT

  • 2-acetamido-2-deoxy-6-O-{hydroxy[2-(trimethylazaniumyl)ethoxy]phosphoryl}-D-galactopyranose

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:59317

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