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CHEBI:234256 - 6-desethyl-OA-6129 A(1−)

ChEBI IDCHEBI:234256
ChEBI Name6-desethyl-OA-6129 A(1−)
Stars
ASCII Name6-desethyl-OA-6129 A(1-)
DefinitionMajor species at pH 7.3.
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC18H26N3O7S
Net Charge-1
Average Mass428.487
Monoisotopic Mass428.14969
SMILES[H][C@@]12CC(=O)N1C(C(=O)[O-])=C(SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)CO)C2
InChIInChI=1S/C18H27N3O7S/c1-18(2,9-22)15(25)16(26)20-4-3-12(23)19-5-6-29-11-7-10-8-13(24)21(10)14(11)17(27)28/h10,15,22,25H,3-9H2,1-2H3,(H,19,23)(H,20,26)(H,27,28)/p-1/t10-,15+/m1/s1
InChIKeyFKPUTSCCLAYOPM-BMIGLBTASA-M
ChEBI Ontology
Outgoing Relation(s)
6-desethyl-OA-6129 A(1−) (CHEBI:234256) is a monocarboxylic acid anion (CHEBI:35757)
UniProt Name  Source
6-desethyl-OA-6129 AUniProt
Citations