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CHEBI:754972 - aftobetin hydrochloride

Default Structure
ChEBI IDCHEBI:754972
ChEBI Nameaftobetin hydrochloride
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaHCl.C26H32N2O5
Net Charge0
Average Mass489.012
Monoisotopic Mass488.20780
SMILESCOCCOCCOCCOC(=O)/C(C#N)=C/c1ccc2cc(N3CCCCC3)ccc2c1.Cl
InChIInChI=1S/C26H32N2O5.ClH/c1-30-11-12-31-13-14-32-15-16-33-26(29)24(20-27)18-21-5-6-23-19-25(8-7-22(23)17-21)28-9-3-2-4-10-28;/h5-8,17-19H,2-4,9-16H2,1H3;1H/b24-18+;
InChIKeyGMWHTUNMFTUKHH-NDUABGMUSA-N
ChEBI Ontology
Outgoing Relation(s)
aftobetin hydrochloride (CHEBI:754972) is a naphthalenes (CHEBI:25477)
Synonyms  Source
11-HClChEMBL
Aftobetin hydrochlorideChEMBL
ANCA-11 HYDROCHLORIDEChEMBL
NCE-11ChEMBL