Baciphelacin (CHEBI:214519)

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CHEBI:214519 - Baciphelacin

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ChEBI ID	CHEBI:214519
ChEBI Name	Baciphelacin
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C22H34N2O6
Net Charge	0
Average Mass	422.522
Monoisotopic Mass	422.24169
SMILES	CCC(N)C(O)C(O)C(C)C(=O)NC(CC(C)C)C1Cc2cccc(O)c2C(=O)O1
InChI	InChI=1S/C22H34N2O6/c1-5-14(23)20(27)19(26)12(4)21(28)24-15(9-11(2)3)17-10-13-7-6-8-16(25)18(13)22(29)30-17/h6-8,11-12,14-15,17,19-20,25-27H,5,9-10,23H2,1-4H3,(H,24,28)
InChIKey	NGHPDQGNXFFIQH-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Bacillus (ncbitaxon:1386)	-	PubMed (1184483)

ChEBI Ontology

Outgoing Relation(s)
	Baciphelacin (CHEBI:214519) has functional parent δ-amino acid (CHEBI:35931)
	Baciphelacin (CHEBI:214519) is a organonitrogen compound (CHEBI:35352)
	Baciphelacin (CHEBI:214519) is a organooxygen compound (CHEBI:36963)

IUPAC Name
5-amino-3,4-dihydroxy-N-[1-(8-hydroxy-1-oxo-3,4-dihydroisochromen-3-yl)-3-methylbutyl]-2-methylheptanamide

Manual Xrefs	Databases
150017	ChemSpider