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CHEBI:190701 - goralatide(1−)

Default Structure
ChEBI IDCHEBI:190701
ChEBI Namegoralatide(1−)
Stars
ASCII Namegoralatide(1-)
DefinitionA peptide anion obtained by removal of protons from the two carboxy groups as well as protonation of the primary amino group of goralatide; major species at pH 7.3.
Last Modified19 April 2022
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H32N5O9
Net Charge-1
Average Mass486.502
Monoisotopic Mass486.22055
SMILESCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)[O-])C(=O)N[C@@H](CCCC[NH3+])C(=O)N1CCC[C@H]1C(=O)[O-]
InChIInChI=1S/C20H33N5O9/c1-11(27)22-14(10-26)18(31)24-13(9-16(28)29)17(30)23-12(5-2-3-7-21)19(32)25-8-4-6-15(25)20(33)34/h12-15,26H,2-10,21H2,1H3,(H,22,27)(H,23,30)(H,24,31)(H,28,29)(H,33,34)/p-1/t12-,13-,14-,15-/m0/s1
InChIKeyHJDRXEQUFWLOGJ-AJNGGQMLSA-M
ChEBI Ontology
Outgoing Relation(s)
goralatide(1−) (CHEBI:190701) is a peptide anion (CHEBI:60334)
goralatide(1−) (CHEBI:190701) is conjugate base of goralatide (CHEBI:191178)
Incoming Relation(s)
goralatide (CHEBI:191178) is conjugate acid of goralatide(1−) (CHEBI:190701)
IUPAC Name 
(2S)-1-(N-{(2S)-2-[(N-acetyl-L-seryl)amino]-3-carboxylatopropanoyl}-6-azaniumyl-L-norleucyl)pyrrolidine-2-carboxylate
Synonyms  Source
Ac-SDKP(1−)ChEBI
AcSDKP(1−)ChEBI
Ac-Ser-Asp-Lys-Pro(1−)ChEBI
N-acetyl-Ser-Asp-Lys-Pro(1−)ChEBI
N-acetyl-L-Ser-L-Asp-L-Lys-L-Pro(1−)ChEBI
N-acetyl-L-seryl-L-aspartyl-L-lysyl-L-proline(1−)ChEBI
UniProt Name  Source
goralatideUniProt
Citations