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Substance Name: 2-(N-Dansyl-4-aminophenylthio)-N-acetyl-9-O-acetylneuraminic acid
RN: 141303-70-0
InChIKey: YRNBBVVAZPSEKQ-DWHFJZGISA-N

Note

  • Used as a sialate-9-O-acetyl-esterase substrate.

Molecular Formula

  • C29-H35-N3-O10-S2

Molecular Weight

  • 649.7385
 
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Names and Synonyms

Name of Substance

  • 2-(N-Dansyl-4-aminophenylthio)-N-acetyl-9-O-acetylneuraminic acid

Synonym

  • Dansyl-apta-ner

Systematic Name

  • D-glycero-alpha-D-galacto-2-Nonulopyranosidonic acid, 4-(((5-(dimethylamino)-1-naphthalenyl)sulfonyl)amino)phenyl 5-(acetylamino)-3,5-dideoxy-2-thio-

Registry Numbers

CAS Registry Number

  • 141303-70-0

System Generated Number

  • 0141303700

Structure Descriptors

InChI

1S/C29H35N3O10S2/c1-16(34)30-25-22(35)14-29(28(38)39,42-27(25)26(37)23(36)15-33)43-18-12-10-17(11-13-18)31-44(40,41)24-9-5-6-19-20(24)7-4-8-21(19)32(2)3/h4-13,22-23,25-27,31,33,35-37H,14-15H2,1-3H3,(H,30,34)(H,38,39)/t22-,23+,25+,26+,27+,29-/m0/s1

InChIKey

YRNBBVVAZPSEKQ-DWHFJZGISA-N

Smiles

CC(=O)N[C@@H]1[C@H](C[C@@](O[C@H]1[C@@H]([C@@H](CO)O)O)(C(=O)O)Sc2ccc(cc2)NS(=O)(=O)c3cccc4c3cccc4N(C)C)O