Pravastatin

Synonyms: Pravastatine, "Pravastatina", "Pravachol", "Eptastatin", "(3R,5R)-3,5-dihydroxy-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-{[(2S)-2-methylbutanoyl]oxy}-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]heptanoic acid"

Source: Pravastatin is a lipid-lowering agent that attenuates atherosclerosis.

Identifiers:

IUPAC Name: (3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-[(2S)-2-methylbutanoyl]oxy-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid
CAS Number: 81093-37-0
PubChem ID: 54687
InChiKey: TUZYXOIXSAXUGO-PZAWKZKUSA-N
Canonical SMILES: CCC(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC(CC(CC(=O)O)O)O)O

Structural Properties:

Molecular Formula: C₂₃H₃₆O₇
Molecular Weight: 424,500

Pharmacophore Features:

Number of bond donors: 4
Number of bond acceptors: 7
Number of atoms different from hydrogen: 30

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Evidence Supporting This Chemical as an Emerging Contaminant

Banjac, Z., Ginebreda, A., Kuzmanovic, M., Marc?, R., Nadal, M., Riera, J. M., & Barcel?, D. (2015). Emission factor estimation of ca. 160 emerging organic microcontaminants by inverse modeling in a Mediterranean river basin (Llobregat, NE Spain). Science of the Total Environment, 520, 241-252.

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2D-structure

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