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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 14:21, 6 December 2011 (Saving copy of the {{drugbox}} taken from revid 458450369 of page Simvastatin for the Chem/Drugbox validation project (updated: 'DrugBank').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.

Revision as of 14:21, 6 December 2011 by Beetstra (talk | contribs) (Saving copy of the {{drugbox}} taken from revid 458450369 of page Simvastatin for the Chem/Drugbox validation project (updated: 'DrugBank').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)
This page contains a copy of the infobox ({{drugbox}}) taken from revid 458450369 of page Simvastatin with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
File:Simvastatin spacefill.png
Clinical data
Trade namesZocor
AHFS/Drugs.comMonograph
MedlinePlusa692030
License data
Pregnancy
category
  • AU: D
Routes of
administration		Oral
ATC code
Legal status
Legal status
Pharmacokinetic data
Bioavailability5%
Protein binding95%
MetabolismHepatic (CYP3A4)
Elimination half-life2 hours for simvastatin and 1.9 hours for simvastatin acid
ExcretionRenal 13%, faecal 60%
Identifiers
IUPAC name
  • (1S,3R,7S,8S,8aR)-8-{2-ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate
CAS Number
PubChem CID
DrugBank
ChemSpider
UNII
KEGG
ChEBI
ChEMBL
Chemical and physical data
FormulaC25H38O5
Molar mass418.566 g/mol g·mol
3D model (JSmol)
SMILES
  • O=C(O13C(=C/(C)C1)\C=C/(3CC2OC(=O)C(O)C2)C)C(C)(C)CC
InChI
  • InChI=1S/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1
  • Key:RYMZZMVNJRMUDD-HGQWONQESA-N
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