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CAS RN 79902-63-9

H3CCH3H3COO(S)(R)H3C(S)CH3(S)(R)(R)HOOO(R)

CAS RN 79902-63-9

IUPAC Name: (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate
Synonyms: simvastatin simvastatine simvastatina simvastatinum simvastatin [usan:ban:inn] zocor
Molecular Weight (g/mol): 418.57
Molecular Formula: C25H38O5
InChi Key: RYMZZMVNJRMUDD-HGQWONQESA-N
SMILES: CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12
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Simvastatin, 98%

CAS: 79902-63-9 Molecular Formula: C25H38O5 Molecular Weight (g/mol): 418.57 InChI Key: RYMZZMVNJRMUDD-HGQWONQESA-N Synonym: simvastatin,zocor,synvinolin,sinvacor,denan,lipex,simvastatine,sivastin,lodales,simvastatina PubChem CID: 54454 ChEBI: CHEBI:9150 IUPAC Name: [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate SMILES: CCC(C)(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)O)C

PubChem CID 54454
CAS 79902-63-9
Molecular Weight (g/mol) 418.57
ChEBI CHEBI:9150
SMILES CCC(C)(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)O)C
Synonym simvastatin,zocor,synvinolin,sinvacor,denan,lipex,simvastatine,sivastin,lodales,simvastatina
IUPAC Name [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate
InChI Key RYMZZMVNJRMUDD-HGQWONQESA-N
Molecular Formula C25H38O5
2

Simvastatin, TRC

CAS: 79902-63-9 Chemical Name or Material: Simvastatin Formula Weight: 418.2719 InChI Formula: 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 IUPAC Name: [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate Molecular Formula: C25 H38 O5 Molecular Weight (g/mol): 418.57 Percent Purity: >95% Purity Grade Notes: HPLC Recommended Storage: -20°C SMILES: CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12 Synonym: Simvastatin,Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl ester,Butanoic acid, 2,2-dimethyl-, 1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl]-1-naphthalenyl ester, [1S-[1α,3α,7β,8β(2S*,4S*),8aβ]]-,(+)-Simvastatin,Apo-Simva,Apo-Simvastatin,Bestatin 20,Cholestat,Co-Simvastatin,Denan,Egilipid,Eucor,Kolestevan,L 644128-000U,Lipex,Lipinorm,Liponorm,Lipovas,Lodales,Lycostatin,MK 733,Modutrol,Nor-Vastina,Novo-Simvastatin,Pms-simvastatin,Rechol,Simastin 20,Simcovas,Simgal,Simi 20,Simlip,Simlip 20,Simlo 20,Simlup 20,Simovil,Simratio,Simvacard,Simvachol,Simvacor,Simvahexal,Simvas,Simvastatin lactone,Simvasterol,Simvastol,Simvofix,Simvotin,Sinvacor,Sinvascor,Sivastin,Starstat 20,Synvinolin,Valemia,Vasilip,Vastan,Vazilip,Velostatin,Ximve,Zocor,Zocor Forte,Zocord,Zorced,Zosta

Percent Purity >95%
CAS 79902-63-9
Molecular Weight (g/mol) 418.57
InChI Formula 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
Chemical Name or Material Simvastatin
Synonym Simvastatin,Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl ester,Butanoic acid, 2,2-dimethyl-, 1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl]-1-naphthalenyl ester, [1S-[1α,3α,7β,8β(2S*,4S*),8aβ]]-,(+)-Simvastatin,Apo-Simva,Apo-Simvastatin,Bestatin 20,Cholestat,Co-Simvastatin,Denan,Egilipid,Eucor,Kolestevan,L 644128-000U,Lipex,Lipinorm,Liponorm,Lipovas,Lodales,Lycostatin,MK 733,Modutrol,Nor-Vastina,Novo-Simvastatin,Pms-simvastatin,Rechol,Simastin 20,Simcovas,Simgal,Simi 20,Simlip,Simlip 20,Simlo 20,Simlup 20,Simovil,Simratio,Simvacard,Simvachol,Simvacor,Simvahexal,Simvas,Simvastatin lactone,Simvasterol,Simvastol,Simvofix,Simvotin,Sinvacor,Sinvascor,Sivastin,Starstat 20,Synvinolin,Valemia,Vasilip,Vastan,Vazilip,Velostatin,Ximve,Zocor,Zocor Forte,Zocord,Zorced,Zosta
SMILES CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12
Recommended Storage -20°C
Purity Grade Notes HPLC
Molecular Formula C25 H38 O5
IUPAC Name [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate
Formula Weight 418.2719
3

Simvastatin 100 μg/mL in Acetonitrile, Dr. Ehrenstorfer

Discover Dr. Ehrenstorfer’s certified reference materials: available in multiple formats, including multi-component regulatory mixtures, to power your food and environmental analysis with traceable, ISO-accredited quality

4

Simvastatin, Mikromol™

Discover Mikromol - your trusted source for high-quality pharmaceutical reference standards. Supporting accurate, compliant analysis with ISO 17034-accredited materials designed for confidence in every result.

5

Simvastatin, LoGiCal

LoGiCal's certified reference materials as neats, native solutions and stable isotope labelled solutions, with expert documentation and support. From forensic to clinical labs, choose LoGiCal for confidence, compliance, and analytical excellence.

6
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Tocris Bioscience™ Simvastatin
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7

Simvastatin, MedChemExpress

MedChemExpress Simvastatin (MK 733) is a competitive inhibitor of HMG-CoA reductase with a Ki of 0.2 nM.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 418.57
Color White
Physical Form Solid
Chemical Name or Material Simvastatin
Grade Research
SMILES CCC(C)(C)C(O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(O3)=O)[C@@]12[H])=O
For Use With (Application) COVID-19-immunoregulation
Percent Purity 99.45%
CAS 79902-63-9
Solubility Information Ethanol : 100 mg/mL (238.91 mM; Need ultrasonic) ∣DMSO : ≥ 50 mg/mL (119.45 mM)
Synonym MK 733
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C25H38O5
Formula Weight 418.57