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Concept information

Preferred term

1-[(2s,3s,6s)-2-(hydroxymethyl)-6-[2-[(phenylmethyl)sulfonylamino]ethyl]-3-oxanyl]-3-propan-2-ylurea  

Type

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

Broader concept

charge

  • 0

formula

  • C19H31N3O5S

inchi

  • InChI=1S/C19H31N3O5S/c1-14(2)21-19(24)22-17-9-8-16(27-18(17)12-23)10-11-20-28(25,26)13-15-6-4-3-5-7-15/h3-7,14,16-18,20,23H,8-13H2,1-2H3,(H2,21,22,24)/t16-,17-,18+/m0/s1

inchikey

  • WDDVSYGCEMHEAU-OKZBNKHCSA-N

mass

  • 413.533

monoisotopicmass

  • 413.19844

smiles

  • CC(C)NC(=O)N[C@H]1CC[C@H](O[C@@H]1CO)CCNS(=O)(=O)CC2=CC=CC=C2

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:120157

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