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CHEBI:212938 - Majusculamide D

ChEBI IDCHEBI:212938
ChEBI NameMajusculamide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H65N5O10
Net Charge0
Average Mass812.018
Monoisotopic Mass811.47314
SMILESCCCCC(C)CC(C)C(=O)N(C)C(Cc1ccc(OC)cc1)C(=O)NC(C(=O)N(C)C(C(=O)N1CC(O)CC1C(=O)N1C(=O)C=CC1C)C(C)C)C(C)OC(C)=O
InChIInChI=1S/C43H65N5O10/c1-12-13-14-26(4)21-27(5)40(53)45(9)34(22-31-16-18-33(57-11)19-17-31)39(52)44-37(29(7)58-30(8)49)42(55)46(10)38(25(2)3)43(56)47-24-32(50)23-35(47)41(54)48-28(6)15-20-36(48)51/h15-20,25-29,32,34-35,37-38,50H,12-14,21-24H2,1-11H3,(H,44,52)
InChIKeyNKBHDXJJPQYANN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Lyngbya majuscula (ncbitaxon:158786) - DOI (10.1016/0031-9422(88)80008-6)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Majusculamide D (CHEBI:212938) is a peptide (CHEBI:16670)
IUPAC Name 
[3-[[2-[2,4-dimethyloctanoyl(methyl)amino]-3-(4-methoxyphenyl)propanoyl]amino]-4-[[1-[4-hydroxy-2-(2-methyl-5-oxo-2H-pyrrole-1-carbonyl)pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]-methylamino]-4-oxobutan-2-yl] acetate
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