Details of the Drug

General Information of Drug (ID: DMCRIHP)

Drug Name
Tirilazad mesylate
Synonyms Freedox (TN)
Indication
Disease Entry ICD 11 Status REF
Cataract 9B10 Approved [1]
Subarachnoid hemorrhage 8B01 Approved [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
Chemical Identifiers
Formula
C39H56N6O5S
Canonical SMILES
CC1CC2C3CCC4=CC(=O)C=CC4(C3=CCC2(C1C(=O)CN5CCN(CC5)C6=NC(=NC(=C6)N7CCCC7)N8CCCC8)C)C.CS(=O)(=O)O
InChI
InChI=1S/C38H52N6O2.CH4O3S/c1-26-22-31-29-9-8-27-23-28(45)10-12-37(27,2)30(29)11-13-38(31,3)35(26)32(46)25-41-18-20-43(21-19-41)34-24-33(42-14-4-5-15-42)39-36(40-34)44-16-6-7-17-44;1-5(2,3)4/h10-12,23-24,26,29,31,35H,4-9,13-22,25H2,1-3H3;1H3,(H,2,3,4)/t26-,29-,31+,35-,37+,38+;/m1./s1
InChIKey
HPZOOQSXPMEJBV-ODCFVKFUSA-N
Cross-matching ID
PubChem CID
104902
ChEBI ID
CHEMBL32233
CAS Number
110101-67-2
TTD ID
D04APR
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References

1 Drugs@FDA. U.S. Food and Drug Administration. U.S. Department of Health & Human Services. 2015