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CHEBI:214808 - Microginin 757

ChEBI IDCHEBI:214808
ChEBI NameMicroginin 757
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC39H59N5O10
Net Charge0
Average Mass757.926
Monoisotopic Mass757.42619
SMILESCCCCCCCC(N)C(O)C(=O)NC(C(=O)N(C)C(CC(C)C)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)O)C(C)O
InChIInChI=1S/C39H59N5O10/c1-6-7-8-9-10-11-29(40)34(48)37(51)43-33(24(4)45)38(52)44(5)32(20-23(2)3)36(50)41-30(21-25-12-16-27(46)17-13-25)35(49)42-31(39(53)54)22-26-14-18-28(47)19-15-26/h12-19,23-24,29-34,45-48H,6-11,20-22,40H2,1-5H3,(H,41,50)(H,42,49)(H,43,51)(H,53,54)
InChIKeyFXNVBPMPLYGNFO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Microcystisspecies (ncbitaxon:1127) - PubMed (16678305)
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 757 (CHEBI:214808) is a peptide (CHEBI:16670)
IUPAC Name 
2-[[2-[[2-[[2-[(3-amino-2-hydroxydecanoyl)amino]-3-hydroxybutanoyl]-methylamino]-4-methylpentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid