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Substance Name: Vascunicol
RN: 8067-26-3
InChIKey: UZNVACLSUTYFTC-OPXAKVPFSA-N

Note

  • Each tablet contains bamethan sulfate 12.5 mg & inositol nicotinate 200 mg; used in the drug therapy of cerebrovascular disorders.

Molecular Weight

  • 2138.11
 
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Names and Synonyms

Name of Substance

  • Vascunicol

Systematic Name

  • myo-Inositol, hexa-3-pyridinecarboxylate, mixt. with alpha-((butylamino)methyl)-4-hydroxybenzenemethanol sulfate (2:1) (salt)

Registry Numbers

CAS Registry Number

  • 8067-26-3

System Generated Number

  • 0008067263

Structure Descriptors

InChI

1S/2C42H30N6O12.2C12H19NO2.H2O4S/c2*49-37(25-7-1-13-43-19-25)55-31-32(56-38(50)26-8-2-14-44-20-26)34(58-40(52)28-10-4-16-46-22-28)36(60-42(54)30-12-6-18-48-24-30)35(59-41(53)29-11-5-17-47-23-29)33(31)57-39(51)27-9-3-15-45-21-27;2*1-2-3-8-13-9-12(15)10-4-6-11(14)7-5-10;1-5(2,3)4/h2*1-24,31-36H;2*4-7,12-15H,2-3,8-9H2,1H3;(H2,1,2,3,4)/t2*31-,32-,33-,34+,35-,36-;;;

InChIKey

UZNVACLSUTYFTC-OPXAKVPFSA-N

Smiles

c1(ccc(cc1)O)[C@@H](CNCCCC)O.S(=O)(=O)(O)O.c1c(cccn1)C(=O)O[C@H]1[C@H]([C@H]([C@H](OC(=O)c2cnccc2)[C@H](OC(=O)c2cnccc2)[C@@H]1OC(=O)c1cnccc1)OC(=O)c1cnccc1)OC(=O)c1cnccc1.c1(ccc(cc1)O)[C@@H](CNCCCC)O.c1c(cccn1)C(=O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](OC(=O)c2cnccc2)[C@@H]1OC(=O)c1cnccc1)OC(=O)c1cnccc1)OC(=O)c1cnccc1)OC(=O)c1cnccc1