CHEBI:120225 - 2-(dimethylamino)-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-[4-(3-methoxyphenyl)-1-triazolyl]ethyl]-3-oxanyl]acetamide

ChEBI IDCHEBI:120225
ChEBI Name2-(dimethylamino)-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-[4-(3-methoxyphenyl)-1-triazolyl]ethyl]-3-oxanyl]acetamide
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FormulaC21H31N5O4
Net Charge0
Average Mass417.510
Monoisotopic Mass417.23760
SMILESCOc1cccc(-c2cn(CC[C@@H]3CC[C@@H](NC(=O)CN(C)C)[C@@H](CO)O3)nn2)c1
InChIInChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18+,20+/m0/s1
InChIKeyKWVYROQUXUCXNL-ILZDJORESA-N
ChEBI Ontology
Outgoing Relation(s)
2-(dimethylamino)-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-[4-(3-methoxyphenyl)-1-triazolyl]ethyl]-3-oxanyl]acetamide (CHEBI:120225) is a amino acid amide (CHEBI:22475)
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LSM-31668LINCS