CHEBI:214519 - Baciphelacin

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Baciphelacin
ChEBI ID CHEBI:214519
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H34N2O6
Net Charge 0
Average Mass 422.522
Monoisotopic Mass 422.24169
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
SMILES O=C1OC(C(NC(=O)C(C(O)C(O)C(N)CC)C)CC(C)C)CC=2C1=C(O)C=CC2
Metabolite of Species Details
Bacillus (NCBI:txid1386) See: PubMed
ChEBI Ontology
Outgoing 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 Xref Database
150017 ChemSpider
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