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CHEBI:222228 - Microginin 725

ChEBI IDCHEBI:222228
ChEBI NameMicroginin 725
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SubmitterMetaboLights
DownloadsMolfile
FormulaC36H60ClN5O8
Net Charge0
Average Mass726.356
Monoisotopic Mass725.41304
SMILESCC(C)CC(C(=O)N(C)C(CC(C)C)C(=O)NC(Cc1ccc(O)cc1)C(=O)O)N(C)C(=O)C(C)NC(=O)C(O)C(N)CCCCCCCCl
InChIInChI=1S/C36H60ClN5O8/c1-22(2)19-29(32(45)40-28(36(49)50)21-25-14-16-26(43)17-15-25)41(6)35(48)30(20-23(3)4)42(7)34(47)24(5)39-33(46)31(44)27(38)13-11-9-8-10-12-18-37/h14-17,22-24,27-31,43-44H,8-13,18-21,38H2,1-7H3,(H,39,46)(H,40,45)(H,49,50)
InChIKeyKKMPGXZFHNAKNE-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 725 (CHEBI:222228) is a peptide (CHEBI:16670)
IUPAC Name 
2-[[2-[[2-[2-[(3-amino-10-chloro-2-hydroxydecanoyl)amino]propanoyl-methylamino]-4-methylpentanoyl]-methylamino]-4-methylpentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid