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Concept information

Preferred term

1-[(2s,3r,6r)-2-(hydroxymethyl)-6-[2-[4-(2-pyridinyl)-1-triazolyl]ethyl]-3-oxanyl]-3-(4-methoxyphenyl)urea  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C23H28N6O4

inchi

  • InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20-,22-/m1/s1

inchikey

  • YPLZJHKSEUDEKT-SYYKKAFVSA-N

mass

  • 452.507

monoisotopicmass

  • 452.21720

smiles

  • COC1=CC=C(C=C1)NC(=O)N[C@@H]2CC[C@@H](O[C@@H]2CO)CCN3C=C(N=N3)C4=CC=CC=N4

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:118033

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