CHEBI:100738 - 1-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-[4-(methoxymethyl)-1-triazolyl]ethyl]-3-oxanyl]-3-[4-(trifluoromethyl)phenyl]urea

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ChEBI Name 1-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-[4-(methoxymethyl)-1-triazolyl]ethyl]-3-oxanyl]-3-[4-(trifluoromethyl)phenyl]urea
ChEBI ID CHEBI:100738
Stars This entity has been manually annotated by a third party.
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Formula C20H26F3N5O4
Net Charge 0
Average Mass 457.448
Monoisotopic Mass 457.19369
InChI InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17+,18+/m1/s1
InChIKey ZOURSNKVQGBTHH-SQNIBIBYSA-N
SMILES COCC1=CN(N=N1)CC[C@H]2CC[C@@H]([C@@H](O2)CO)NC(=O)NC3=CC=C(C=C3)C(F)(F)F
ChEBI Ontology
Outgoing 1-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-[4-(methoxymethyl)-1-triazolyl]ethyl]-3-oxanyl]-3-[4-(trifluoromethyl)phenyl]urea (CHEBI:100738) is a C-glycosyl compound (CHEBI:20857)
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