CHEBI:161159 - Met-Trp-Tyr

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Met-Trp-Tyr
ChEBI ID CHEBI:161159
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C25H30N4O5S
Net Charge 0
Average Mass 498.600
Monoisotopic Mass 498.19369
InChI InChI=1S/C25H30N4O5S/c1-35-11-10-19(26)23(31)28-21(13-16-14-27-20-5-3-2-4-18(16)20)24(32)29-22(25(33)34)12-15-6-8-17(30)9-7-15/h2-9,14,19,21-22,27,30H,10-13,26H2,1H3,(H,28,31)(H,29,32)(H,33,34)/t19-,21-,22-/m0/s1
InChIKey CONKYWFMLIMRLU-BVSLBCMMSA-N
SMILES S(CC[C@H](N)C(=O)N[C@@H](CC=1C=2C(NC1)=CC=CC2)C(=O)N[C@@H](CC3=CC=C(O)C=C3)C(O)=O)C
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Met-Trp-Tyr (CHEBI:161159) is a oligopeptide (CHEBI:25676)
IUPAC Name
(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid