CHEBI:183138 - Ala-Trp-Ser-Ser

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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 Ala-Trp-Ser-Ser
ChEBI ID CHEBI:183138
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H27N5O7
Net Charge 0
Average Mass 449.464
Monoisotopic Mass 449.19105
InChI InChI=1S/C20H27N5O7/c1-10(21)17(28)23-14(6-11-7-22-13-5-3-2-4-12(11)13)18(29)24-15(8-26)19(30)25-16(9-27)20(31)32/h2-5,7,10,14-16,22,26-27H,6,8-9,21H2,1H3,(H,23,28)(H,24,29)(H,25,30)(H,31,32)
InChIKey MRXZVZVKYZELRU-UHFFFAOYSA-N
SMILES O=C(NC(CO)C(=O)NC(CO)C(O)=O)C(NC(=O)C(N)C)CC=1C=2C(NC1)=CC=CC2
Metabolite of Species Details
Trypanosoma brucei (NCBI:txid5691) Found in cell culture (BTO:0000214). See: MetaboLights Study
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 Ala-Trp-Ser-Ser (CHEBI:183138) is a oligopeptide (CHEBI:25676)
IUPAC Name
2-[[2-[[2-(2-aminopropanoylamino)-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxypropanoic acid
Manual Xref Database
16583186 ChemSpider
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