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Substance Name: Sialosylparagloboside
RN: 71833-57-3
InChIKey: OWMXULOUTAAVIX-HNZIOFRCSA-N

Note

  • See also record for sialosylgloboside.

Molecular Weight

  • 1546.8279
 
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Names and Synonyms

Name of Substance

  • Sialosylparagloboside

Synonym

  • Neunac(alpha,2-73)gal(beta,1-74)glcnac(beta,1-73)gal(beta,1-74)glc-cer

Systematic Names

  • Ceramide, 1-O-(O-(N-acetyl-alpha-neuraminosyl)-(2-3)-O-beta-D-galactopyranosyl-(1-4)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1-3)-O-beta-D-galactopyranosyl-(1-4)-beta-D-glucopyranosyl)-
  • Paragloboside, O-(N-acetyl-alpha-neuraminosyl)-(2-3D)-

Registry Numbers

CAS Registry Number

  • 71833-57-3

System Generated Number

  • 0071833573

Structure Descriptors

InChI

InChI=1S/C73H131N3O31/c1-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-52(87)76-44(45(84)33-31-29-27-25-23-21-18-16-14-12-10-8-6-2)41-98-69-60(93)59(92)63(51(40-81)102-69)103-70-61(94)66(57(90)49(38-79)100-70)105-68-54(75-43(4)83)64(56(89)48(37-78)99-68)104-71-62(95)67(58(91)50(39-80)101-71)107-73(72(96)97)35-46(85)53(74-42(3)82)65(106-73)55(88)47(86)36-77/h31,33,44-51,53-71,77-81,84-86,88-95H,5-30,32,34-41H2,1-4H3,(H,74,82)(H,75,83)(H,76,87)(H,96,97)/b33-31-/t44?,45?,46-,47?,48-,49-,50-,51-,53+,54-,55?,56+,57+,58+,59-,60-,61-,62-,63-,64-,65+,66+,67+,68+,69-,70+,71+,73+/m1/s1

InChIKey

OWMXULOUTAAVIX-HNZIOFRCSA-N

Smiles

CCCCCCCCCCCCCCCCCC(=O)NC(CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@@]5(C[C@@H](O)[C@H](NC(=O)C)[C@H](O5)C(O)C(O)CO)C(=O)O)[C@H]4O)[C@H]3NC(=O)C)[C@H]2O)[C@H](O)[C@H]1O)C(O)\C=C/CCCCCCCCCCCCC