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CHEBI:97248 - N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]oxan-3-yl]-1,3-benzodioxole-5-carboxamide

ChEBI IDCHEBI:97248
ChEBI NameN-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]oxan-3-yl]-1,3-benzodioxole-5-carboxamide
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DownloadsMolfile
FormulaC21H29N3O6
Net Charge0
Average Mass419.478
Monoisotopic Mass419.20564
SMILESCN1CCN(C(=O)C[C@@H]2CC[C@H](NC(=O)c3ccc4c(c3)OCO4)[C@@H](CO)O2)CC1
InChIInChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16-,19+/m0/s1
InChIKeyOCHDOPTVTSINTO-TXPKVOOTSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]oxan-3-yl]-1,3-benzodioxole-5-carboxamide (CHEBI:97248) is a C-glycosyl compound (CHEBI:20857)
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