6’-Hydroxymethyl Simvastatin Acid Sodium Salt

For research use only. Not for therapeutic Use.

  • CAT Number: R004829
  • CAS Number: 134452-13-4
  • Molecular Formula: C25H39NaO7
  • Molecular Weight: 474.57
  • Purity: ≥95%
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Catalog Number R004829
CAS Number 134452-13-4
Synonyms

[1S-[1α(βS*,δR*),2α,6α,8β,8aα]]- 8-(2,2-Dimethyl-1-oxobutoxy)-1,2,6,7,8,8a?-hexahydro-β,δ-dihydroxy-6-(hydroxymethyl)-2-methyl-1-naphthaleneheptanoic Acid Sodium Salt;

Molecular Formula C25H39NaO7
Purity ≥95%
Storage -20°C
IUPAC Name sodium;(3R,5R)-7-[(1S,2S,8S,8aR)-8-(2,2-dimethylbutanoyloxy)-6-(hydroxymethyl)-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate
InChI InChI=1S/C25H40O7.Na/c1-5-25(3,4)24(31)32-21-11-16(14-26)10-17-7-6-15(2)20(23(17)21)9-8-18(27)12-19(28)13-22(29)30;/h6-7,10,15-16,18-21,23,26-28H,5,8-9,11-14H2,1-4H3,(H,29,30);/q;+1/p-1/t15-,16?,18+,19+,20-,21-,23-;/m0./s1
InChIKey RXAZZPBMZAGLFJ-KYBYJIBGSA-M
SMILES CCC(C)(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC(CC(CC(=O)[O-])O)O)CO.[Na+]

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