CHEBI:199086 - Taveuniamide E

ChEBI IDCHEBI:199086
ChEBI NameTaveuniamide E
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SubmitterMetaboLights
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FormulaC19H22Cl3NO3
Net Charge0
Average Mass418.748
Monoisotopic Mass417.06653
SMILESCOC(=O)[C@H](CCC#CC=C(Cl)Cl)[C@@H](CCCC#C/C=C/Cl)NC(C)=O
InChIInChI=1S/C19H22Cl3NO3/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/h10,13-14,16-17H,4,7-8,11-12H2,1-2H3,(H,23,24)/b14-10+/t16-,17-/m1/s1
InChIKeyVRCCZDSYIXKCQV-PNUWANSTSA-N
Species of MetaboliteComponentSourceComments
Lyngbya majuscula (ncbitaxon:158786) - DOI (10.1016/j.tet.2004.02.076)
ChEBI Ontology
Outgoing Relation(s)
Taveuniamide E (CHEBI:199086) has functional parent β-amino acid (CHEBI:33706)
Taveuniamide E (CHEBI:199086) is a organonitrogen compound (CHEBI:35352)
Taveuniamide E (CHEBI:199086) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
methyl (E,2R,3R)-3-acetamido-10-chloro-2-(6,6-dichlorohex-5-en-3-ynyl)dec-9-en-7-ynoate
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