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Chemical structure of Pravastatin lactone

GC44676

Pravastatin lactone

Also known as [(1S,3S,7S,8S,8aR)-3-hydroxy-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate

Pravastatin lactone is a metabolite of pravastatin, a hydroxymethylglutaryl-coenzyme A (HMG-CoA) reductase inhibitor that is a ring-hydroxylated metabolite of mevastatin

ChemicalCAS85956-22-5MW406.5FormulaC23H34O6
CAS number
85956-22-5
Molecular weight
406.5
Formula
C23H34O6
Solubility
DMF： 25 mg/ml,DMSO： 20 mg/ml,Ethanol： 12·5 mg/ml,PBS (pH 7·2)： 10 mg/ml
InChIKey
OQARDMYXSOFTLN-PZAWKZKUSA-N
Catalogue number
GC44676
Brand
GLPBIO
Computed properties PubChem CID 9931182 · XLogP 2.4 · TPSA 93.1 Ų · H-bond donors 2
XLogP
2.4
TPSA
93.1 Ų
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
29

SMILES CC[C@H](C)C(=O)O[C@H]1C[C@@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3C[C@H](CC(=O)O3)O)O

Computed descriptors from PubChem (CID 9931182), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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