CHEBI:111341 - 4-(1H-indol-3-yl)butanoic acid [2-(4-amino-1,3-dimethyl-2,6-dioxo-5-pyrimidinyl)-2-oxoethyl] ester

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ChEBI Name 4-(1H-indol-3-yl)butanoic acid [2-(4-amino-1,3-dimethyl-2,6-dioxo-5-pyrimidinyl)-2-oxoethyl] ester
ChEBI ID CHEBI:111341
Stars This entity has been manually annotated by a third party.
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Formula C20H22N4O5
Net Charge 0
Average Mass 398.413
Monoisotopic Mass 398.15902
InChI InChI=1S/C20H22N4O5/c1-23-18(21)17(19(27)24(2)20(23)28)15(25)11-29-16(26)9-5-6-12-10-22-14-8-4-3-7-13(12)14/h3-4,7-8,10,22H,5-6,9,11,21H2,1-2H3
InChIKey AYSJAJQRWZRMLC-UHFFFAOYSA-N
SMILES CN1C(=C(C(=O)N(C1=O)C)C(=O)COC(=O)CCCC2=CNC3=CC=CC=C32)N
ChEBI Ontology
Outgoing 4-(1H-indol-3-yl)butanoic acid [2-(4-amino-1,3-dimethyl-2,6-dioxo-5-pyrimidinyl)-2-oxoethyl] ester (CHEBI:111341) is a indoles (CHEBI:24828)
Manual Xref Database
LSM-22797 LINCS
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