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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > ureas > 2-[(2s,3r,6s)-3-[[anilino(oxo)methyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2h-pyran-6-yl]acetic acid

Preferred term

2-[(2s,3r,6s)-3-[[anilino(oxo)methyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2h-pyran-6-yl]acetic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C15H18N2O5

inchi

  • InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13-/m1/s1

inchikey

  • IZNXMLLZVKASMZ-JHJVBQTASA-N

mass

  • 306.314

monoisotopicmass

  • 306.12157

smiles

  • C1=CC=C(C=C1)NC(=O)N[C@@H]2C=C[C@@H](O[C@@H]2CO)CC(=O)O

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:118341

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