CHEBI:164690 - Trp-Gly-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 Trp-Gly-Trp
ChEBI ID CHEBI:164690
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/c25-18(9-14-11-26-19-7-3-1-5-16(14)19)23(31)28-13-22(30)29-21(24(32)33)10-15-12-27-20-8-4-2-6-17(15)20/h1-8,11-12,18,21,26-27H,9-10,13,25H2,(H,28,31)(H,29,30)(H,32,33)/t18-,21-/m0/s1
InChIKey YRXXUYPYPHRJPB-RXVVDRJESA-N
SMILES O=C(NCC(=O)N[C@@H](CC=1C=2C(NC1)=CC=CC2)C(O)=O)[C@@H](N)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 Trp-Gly-Trp (CHEBI:164690) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]-3-(1H-indol-3-yl)propanoic acid