CHEBI:201968 - Taveuniamide A

ChEBI IDCHEBI:201968
ChEBI NameTaveuniamide A
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SubmitterMetaboLights
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FormulaC19H28Cl3NO3
Net Charge0
Average Mass424.796
Monoisotopic Mass423.11348
SMILESCOC(=O)C(CCCCCC(Cl)Cl)C(CCCC#C/C=C/Cl)NC(C)=O
InChIInChI=1S/C19H28Cl3NO3/c1-15(24)23-17(12-8-4-3-5-10-14-20)16(19(25)26-2)11-7-6-9-13-18(21)22/h10,14,16-18H,4,6-9,11-13H2,1-2H3,(H,23,24)/b14-10+
InChIKeyGRLUPGAXRLOURI-GXDHUFHOSA-N
Species of MetaboliteComponentSourceComments
Lyngbya majuscula (ncbitaxon:158786) - DOI (10.1016/j.tet.2004.02.076)
ChEBI Ontology
Outgoing Relation(s)
Taveuniamide A (CHEBI:201968) has functional parent β-amino acid (CHEBI:33706)
Taveuniamide A (CHEBI:201968) is a organonitrogen compound (CHEBI:35352)
Taveuniamide A (CHEBI:201968) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
methyl (E)-3-acetamido-10-chloro-2-(6,6-dichlorohexyl)dec-9-en-7-ynoate
Manual XrefsDatabases
9548551ChemSpider