CHEBI:165574 - N-Stearoyl tyrosine

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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 N-Stearoyl tyrosine
ChEBI ID CHEBI:165574
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C27H45NO4
Net Charge 0
Average Mass 447.660
Monoisotopic Mass 447.33486
InChI InChI=1S/C27H45NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(30)28-25(27(31)32)22-23-18-20-24(29)21-19-23/h18-21,25,29H,2-17,22H2,1H3,(H,28,30)(H,31,32)/t25-/m0/s1
InChIKey YKWCFTGLODSOSB-VWLOTQADSA-N
SMILES O=C(N[C@@H](CC1=CC=C(O)C=C1)C(O)=O)CCCCCCCCCCCCCCCCC
ChEBI Ontology
Outgoing N-Stearoyl tyrosine (CHEBI:165574) is a tyrosine derivative (CHEBI:62761)
IUPAC Name
(2S)-3-(4-hydroxyphenyl)-2-(octadecanoylamino)propanoic acid
Manual Xrefs Databases
5142268 ChemSpider
HMDB0062343 HMDB
LMFA08020100 LIPID MAPS
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Registry Number Type Source
57993-25-6 CAS Registry Number ChemIDplus