6’-Hydroxymethyl Simvastatin

For research use only. Not for therapeutic Use.

  • CAT Number: R004828
  • CAS Number: 114883-29-3
  • Molecular Formula: C25H38O6
  • Molecular Weight: 434.573
  • Purity: ≥95%
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Catalog Number R004828
CAS Number 114883-29-3
Synonyms

2,2-Dimethylbutanoic Acid [1S-[1α,3α,7α,8β(2S*,4S*),8aβ]]-1,2,3,7,8,8a?-hexahydro-3-(hydroxymethyl)-7-methyl-8-[2-(tetrahydro-4-hydroxy?-6-oxo-2H-pyran-2-yl)ethyl]-1-naphthalenyl Ester

Molecular Formula C25H38O6
Purity ≥95%
Storage -20°C
IUPAC Name [(1S,3R,7S,8S,8aR)-3-(hydroxymethyl)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate
InChI InChI=1S/C25H38O6/c1-5-25(3,4)24(29)31-21-11-16(14-26)10-17-7-6-15(2)20(23(17)21)9-8-19-12-18(27)13-22(28)30-19/h6-7,10,15-16,18-21,23,26-27H,5,8-9,11-14H2,1-4H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1
InChIKey ATPFRGQBOVFFQM-HGQWONQESA-N
SMILES CCC(C)(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)O)CO

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