CHEBI:100006 - N-(1,3-benzodioxol-5-ylmethyl)-2-[(2R,3R,6S)-3-[[(2,5-difluoroanilino)-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetamide

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ChEBI Name N-(1,3-benzodioxol-5-ylmethyl)-2-[(2R,3R,6S)-3-[[(2,5-difluoroanilino)-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetamide
ChEBI ID CHEBI:100006
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H23F2N3O6
Net Charge 0
Average Mass 475.443
Monoisotopic Mass 475.15549
InChI InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21+/m1/s1
InChIKey VZUMNNKKGVSTKF-CEQIKUNHSA-N
SMILES C1OC2=C(O1)C=C(C=C2)CNC(=O)C[C@H]3C=C[C@H]([C@@H](O3)CO)NC(=O)NC4=C(C=CC(=C4)F)F
ChEBI Ontology
Outgoing N-(1,3-benzodioxol-5-ylmethyl)-2-[(2R,3R,6S)-3-[[(2,5-difluoroanilino)-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetamide (CHEBI:100006) is a ureas (CHEBI:47857)
Manual Xref Database
LSM-11385 LINCS
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