5-BROMO-4-CHLORO-3-INDOLYL-ALPHA-D-N-ACETYLNEURAMINIC ACID SODIUM SALT

CAS No.
160369-85-7
CCD No.
CCD00162543
Formula
C19 H21 Br Cl N2 O9 . Na
MolWeight
559.727

Basic Information

Product Name: 5-BROMO-4-CHLORO-3-INDOLYL-ALPHA-D-N-ACETYLNEURAMINIC ACID SODIUM SALT
CAS: 160369-85-7
English Synonyms: 5-BROMO-4-CHLORO-3-INDOLYL N-ACETYL-ALPHA-D-N-ACETYLNEURAMINIC ACID SODIUM SALT ; X-NEUNAC ; 5-BROMO-4-CHLORO-3-INDOXYL-ALPHA-D-N-ACETYLNEURAMINIC ACID, SODIUM SALT ; N-ACETYL-2-O-(5-BROMO-4-CHLORO-1H-INDOL-3-YL)-ALPHA-NEURAMINIC ACID MONOSODIUM SALT ; 5-BROMO-4-CHLORO-3-INDOLYL-ALPHA-D-N-ACETYLNEURAMINIC ACID SODIUM SALT ; A-NEURAMINIC ACID, N-ACETYL-2-O-(5-BROMO-4-CHLORO-1H-INDOL-3-YL)-, MONOSODIUM SALT ; X-NANA NA ; 5-BROMO-4-CHLORO-3-INDOLYL-ALPHA-D-N-ACETYLNEURAMINIC ACID SODIUM ; X-NEUNAC SODIUM SALT ; 5-BROMO-4-CHLORO-3-INDOLYL A-D-N-ACETYLNEURAMINIC ACID SODIUM SALT ; 5-BROMO-4-CHLORO-1H-INDOL-3-YL 5-(ACETYLAMINO)-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSIDONIC ACID MONOSODIUM SALT
MDL Number.: MFCD00792680
H bond acceptor: 11
H bond donor: 6
Smile: CC(=O)N[C@@H]1[C@H](C[C@@](O[C@H]1[C@@H]([C@@H](CO)O)O)(C(=O)[O-])Oc2c[nH]c3c2c(c(cc3)Br)Cl)O.[Na+]
InChi: InChI=1S/C19H22BrClN2O9.Na/c1-7(25)23-15-10(26)4-19(18(29)30,32-17(15)16(28)11(27)6-24)31-12-5-22-9-3-2-8(20)14(21)13(9)12;/h2-3,5,10-11,15-17,22,24,26-28H,4,6H2,1H3,(H,23,25)(H,29,30);/q;+1/p-1/t10-,11+,15+,16+,17+,19+;/m0./s1
InChiKey: InChIKey=MNWWXEDVLXNFDD-GNZCRVNMSA-M

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