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Substance Name: Rivipansel sodium [USAN]
RN: 1189037-60-2
UNII: 11AEN6VWDN
InChIKey: QQDCIMVGFXSAJH-DJFGCAFRSA-J

Note

  • A glycomimetic pan-selectin antagonist that reverses acute vascular occlusions in sickle cell mice.

Molecular Formulas

  • C58-H70-N6-Na4-O31-S3
  • C58-H70-N6-O31-S3.4Na
  • C58-H74-N6-O31-S3.4Na

Molecular Weight

  • 1535.36
 
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Names and Synonyms

Name of Substance

  • Rivipansel sodium [USAN]

Synonyms

  • GMI 1070
  • GMI-1070
  • PF-06460031-02
  • Rivipansel sodium
  • UNII-11AEN6VWDN

Systematic Name

  • 1,3,6-Naphthalenetrisulfonic acid, 8-((13-((1R,3R,4R,5S)-3-((2-O-benzoyl-3-O-((1S)-1-carboxy-2-cyclohexylethyl)-beta-D-galactopyranosyl)oxy)-4-((6-deoxy-alpha-L-galactopyranosyl)oxy)-5-(((1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)carbonyl)amino)cyclohexyl)-1,8,13-trioxo-3,6-dioxa-9,12-diazatridec-1-yl)amino)-, sodium salt (1:4)

Registry Numbers

CAS Registry Number

  • 1189037-60-2

FDA UNII

  • 11AEN6VWDN

System Generated Number

  • 1189037602

Structure Descriptors

InChI

1S/C58H74N6O31S3.4Na/c1-27-45(69)47(71)48(72)56(90-27)95-49-35(62-53(74)36-23-41(66)64-58(78)63-36)19-31(20-37(49)92-57-51(94-55(77)29-10-6-3-7-11-29)50(46(70)39(24-65)93-57)91-38(54(75)76)16-28-8-4-2-5-9-28)52(73)60-13-12-59-42(67)25-88-14-15-89-26-43(68)61-34-21-32(96(79,80)81)17-30-18-33(97(82,83)84)22-40(44(30)34)98(85,86)87;;;;/h3,6-7,10-11,17-18,21-23,27-28,31,35,37-39,45-51,56-57,65,69-72H,2,4-5,8-9,12-16,19-20,24-26H2,1H3,(H,59,67)(H,60,73)(H,61,68)(H,62,74)(H,75,76)(H,79,80,81)(H,82,83,84)(H,85,86,87)(H2,63,64,66,78);;;;/q;4*+1/p-4/t27-,31+,35-,37+,38-,39+,45+,46-,47+,48-,49+,50-,51+,56-,57+;;;;/m0..../s1

InChIKey

QQDCIMVGFXSAJH-DJFGCAFRSA-J

Smiles

[Na+].[Na+].[Na+].[Na+].C[C@@H]1O[C@@H](O[C@@H]2[C@H](C[C@H](C[C@H]2O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H](CC4CCCCC4)C(=O)[O-])[C@H]3OC(=O)c5ccccc5)C(=O)NCCNC(=O)COCCOCC(=O)Nc6cc(cc7cc(cc(c67)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)C8=CC(=O)NC(=O)N8)[C@@H](O)[C@H](O)[C@@H]1O