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CHEBI:221930 - N-methyltyrosyl-N-methyltyrosyl-leucyl-alanine

ChEBI IDCHEBI:221930
ChEBI NameN-methyltyrosyl-N-methyltyrosyl-leucyl-alanine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H40N4O7
Net Charge0
Average Mass556.660
Monoisotopic Mass556.28970
SMILESCN[C@@H](Cc1ccc(O)cc1)C(=O)N(C)[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O
InChIInChI=1S/C29H40N4O7/c1-17(2)14-23(26(36)31-18(3)29(39)40)32-27(37)25(16-20-8-12-22(35)13-9-20)33(5)28(38)24(30-4)15-19-6-10-21(34)11-7-19/h6-13,17-18,23-25,30,34-35H,14-16H2,1-5H3,(H,31,36)(H,32,37)(H,39,40)/t18-,23-,24-,25-/m0/s1
InChIKeyRMTBEJIJFWZNPI-MGKKLRQFSA-N
Species of MetaboliteComponentSourceComments
Streptomyces griseus (ncbitaxon:1911) - PubMed (8002381)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
N-methyltyrosyl-N-methyltyrosyl-leucyl-alanine (CHEBI:221930) is a oligopeptide (CHEBI:25676)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-3-(4-hydroxyphenyl)-2-[[(2S)-3-(4-hydroxyphenyl)-2-(methylamino)propanoyl]-methylamino]propanoyl]amino]-4-methylpentanoyl]amino]propanoic acid
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8545920ChemSpider