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CHEBI:63660 - pravastatin(1−)

ChEBI IDCHEBI:63660
ChEBI Namepravastatin(1−)
Stars
ASCII Namepravastatin(1-)
DefinitionA monocarboxylic acid anion resulting from the deprotonation of the carboxylic acid group of pravastatin.
Last Modified4 May 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC23H35O7
Net Charge-1
Average Mass423.526
Monoisotopic Mass423.23883
SMILES[H][C@@]12C(=C[C@@H](O)C[C@@H]1OC(=O)[C@@H](C)CC)C=C[C@H](C)[C@@H]2CC[C@@H](O)C[C@@H](O)CC(=O)[O-]
InChIInChI=1S/C23H36O7/c1-4-13(2)23(29)30-20-11-17(25)9-15-6-5-14(3)19(22(15)20)8-7-16(24)10-18(26)12-21(27)28/h5-6,9,13-14,16-20,22,24-26H,4,7-8,10-12H2,1-3H3,(H,27,28)/p-1/t13-,14-,16+,17+,18+,19-,20-,22-/m0/s1
InChIKeyTUZYXOIXSAXUGO-PZAWKZKUSA-M
ChEBI Ontology
Outgoing Relation(s)
pravastatin(1−) (CHEBI:63660) is a monocarboxylic acid anion (CHEBI:35757)
pravastatin(1−) (CHEBI:63660) is conjugate base of pravastatin (CHEBI:63618)
Incoming Relation(s)
pravastatin sodium (CHEBI:8361) has part pravastatin(1−) (CHEBI:63660)
pravastatin (CHEBI:63618) is conjugate acid of pravastatin(1−) (CHEBI:63660)
IUPAC Name 
(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]heptanoate
UniProt Name  Source
pravastatinUniProt