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CHEBI:222314 - Microginin 578A

ChEBI IDCHEBI:222314
ChEBI NameMicroginin 578A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H50N4O7
Net Charge0
Average Mass578.751
Monoisotopic Mass578.36795
SMILESCCCCCCCC(NC)C(O)C(=O)NC(C)C(=O)N(C)C(CC(C)C)C(=O)NC(Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C30H50N4O7/c1-7-8-9-10-11-12-23(31-5)26(36)28(38)32-20(4)29(39)34(6)25(17-19(2)3)27(37)33-24(30(40)41)18-21-13-15-22(35)16-14-21/h13-16,19-20,23-26,31,35-36H,7-12,17-18H2,1-6H3,(H,32,38)(H,33,37)(H,40,41)
InChIKeyASGNRABWPWMWMJ-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Microginin 578A (CHEBI:222314) is a peptide (CHEBI:16670)
IUPAC Name 
2-[[2-[2-[[2-hydroxy-3-(methylamino)decanoyl]amino]propanoyl-methylamino]-4-methylpentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid