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CHEBI:222145 - Microginin 755B

ChEBI IDCHEBI:222145
ChEBI NameMicroginin 755B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC40H61N5O9
Net Charge0
Average Mass755.954
Monoisotopic Mass755.44693
SMILESCCCCCCCC(NC)C(O)C(=O)NC(C)C(=O)N(C)C(CC(C)C)C(=O)N(C)C(Cc1ccc(O)cc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C40H61N5O9/c1-8-9-10-11-12-13-31(41-5)35(48)37(50)42-26(4)38(51)45(7)34(22-25(2)3)39(52)44(6)33(24-28-16-20-30(47)21-17-28)36(49)43-32(40(53)54)23-27-14-18-29(46)19-15-27/h14-21,25-26,31-35,41,46-48H,8-13,22-24H2,1-7H3,(H,42,50)(H,43,49)(H,53,54)
InChIKeyRNKRRAYDCMRPRF-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 755B (CHEBI:222145) is a peptide (CHEBI:16670)
IUPAC Name 
2-[[2-[[2-[2-[[2-hydroxy-3-(methylamino)decanoyl]amino]propanoyl-methylamino]-4-methylpentanoyl]-methylamino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid