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Substance Name: Rivipansel [USAN:INN]
RN: 927881-99-0
UNII: 4B115V09LB
InChIKey: VXBNTHRZPJLRSS-PTCSXESPSA-N

Note

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

Molecular Formula

  • C58-H74-N6-O31-S3

Molecular Weight

  • 1447.4316
 
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Names and Synonyms

Name of Substance

  • Rivipansel [USAN:INN]

Synonyms

  • GMI-1070
  • PF-06460031
  • Rivipansel
  • UNII-4B115V09LB

Registry Numbers

CAS Registry Number

  • 927881-99-0

FDA UNII

  • 4B115V09LB

System Generated Number

  • 0927881990

Structure Descriptors

InChI

1S/C58H74N6O31S3/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)/t27-,31+,35-,37+,38-,39+,45+,46-,47+,48-,49+,50-,51+,56-,57+/m0/s1

InChIKey

VXBNTHRZPJLRSS-PTCSXESPSA-N

Smiles

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