CHEBI:164101 - Gly-Trp-Trp

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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 Gly-Trp-Trp
ChEBI ID CHEBI:164101
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H25N5O4
Net Charge 0
Average Mass 447.495
Monoisotopic Mass 447.19065
InChI InChI=1S/C24H25N5O4/c25-11-22(30)28-20(9-14-12-26-18-7-3-1-5-16(14)18)23(31)29-21(24(32)33)10-15-13-27-19-8-4-2-6-17(15)19/h1-8,12-13,20-21,26-27H,9-11,25H2,(H,28,30)(H,29,31)(H,32,33)/t20-,21-/m0/s1
InChIKey WSLHFAFASQFMSK-SFTDATJTSA-N
SMILES O=C(N[C@@H](CC=1C=2C(NC1)=CC=CC2)C(O)=O)[C@@H](NC(=O)CN)CC=3C=4C(NC3)=CC=CC4
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing Gly-Trp-Trp (CHEBI:164101) is a oligopeptide (CHEBI:25676)
IUPAC Name
(2S)-2-[[(2S)-2-[(2-aminoacetyl)amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
Manual Xref Database
57572057 ChemSpider
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