CHEBI:59125 - fosinopril(1−)

ChEBI IDCHEBI:59125
ChEBI Namefosinopril(1−)
Stars
ASCII Namefosinopril(1-)
DefinitionThe anion formed by deprotonating fosinopril at the carboxyl proton.
Last Modified25 March 2010
SubmitterGareth Owen
DownloadsMolfile
FormulaC30H45NO7P
Net Charge-1
Average Mass562.664
Monoisotopic Mass562.29391
SMILES[H][C@@]1(C2CCCCC2)C[C@@H](C(=O)[O-])N(C(=O)CP(=O)(CCCCc2ccccc2)OC(OC(=O)CC)C(C)C)C1
InChIInChI=1S/C30H46NO7P/c1-4-28(33)37-30(22(2)3)38-39(36,18-12-11-15-23-13-7-5-8-14-23)21-27(32)31-20-25(19-26(31)29(34)35)24-16-9-6-10-17-24/h5,7-8,13-14,22,24-26,30H,4,6,9-12,15-21H2,1-3H3,(H,34,35)/p-1/t25-,26+,30?,39?/m1/s1
InChIKeyBIDNLKIUORFRQP-FKDWWROVSA-M
ChEBI Ontology
Outgoing Relation(s)
fosinopril(1−) (CHEBI:59125) is a monocarboxylic acid anion (CHEBI:35757)
fosinopril(1−) (CHEBI:59125) is conjugate base of fosinopril (CHEBI:5163)
Incoming Relation(s)
fosinopril sodium (CHEBI:5164) has part fosinopril(1−) (CHEBI:59125)
fosinopril (CHEBI:5163) is conjugate acid of fosinopril(1−) (CHEBI:59125)
IUPAC Name 
(2S,4S)-4-cyclohexyl-1-({[2-methyl-1-(propanoyloxy)propoxy](4-phenylbutyl)phosphoryl}acetyl)pyrrolidine-2-carboxylate
Synonym  Source
(4S)-4-cyclohexyl-1-({[2-methyl-1-(propanoyloxy)propoxy](4-phenylbutyl)phosphoryl}acetyl)-L-prolinateChEBI
Registry NumbersSources
Beilstein:6835932Beilstein