CHEBI:97723 - N-[(2R,3S,6S)-6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]pyrazine-2-carboxamide

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ChEBI Name N-[(2R,3S,6S)-6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]pyrazine-2-carboxamide
ChEBI ID CHEBI:97723
Stars This entity has been manually annotated by a third party.
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Formula C25H30N4O4
Net Charge 0
Average Mass 450.531
Monoisotopic Mass 450.22671
InChI InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21+,23+/m1/s1
InChIKey USGDOGGJJOICMT-GIWBLDEGSA-N
SMILES C1CN(CCC1CC2=CC=CC=C2)C(=O)C[C@H]3C=C[C@@H]([C@@H](O3)CO)NC(=O)C4=NC=CN=C4
ChEBI Ontology
Outgoing N-[(2R,3S,6S)-6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]pyrazine-2-carboxamide (CHEBI:97723) is a piperidines (CHEBI:26151)
Manual Xref Database
LSM-9102 LINCS
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