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Concept information

organooxygen compound > oxacycle > pyrans > 2-[(2s,3s,6s)-2-(hydroxymethyl)-3-(1-oxopropylamino)-3,6-dihydro-2h-pyran-6-yl]acetic acid methyl ester
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > 2-[(2s,3s,6s)-2-(hydroxymethyl)-3-(1-oxopropylamino)-3,6-dihydro-2h-pyran-6-yl]acetic acid methyl ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > 2-[(2s,3s,6s)-2-(hydroxymethyl)-3-(1-oxopropylamino)-3,6-dihydro-2h-pyran-6-yl]acetic acid methyl ester
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyrans > 2-[(2s,3s,6s)-2-(hydroxymethyl)-3-(1-oxopropylamino)-3,6-dihydro-2h-pyran-6-yl]acetic acid methyl ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyrans > 2-[(2s,3s,6s)-2-(hydroxymethyl)-3-(1-oxopropylamino)-3,6-dihydro-2h-pyran-6-yl]acetic acid methyl ester

Preferred term

2-[(2s,3s,6s)-2-(hydroxymethyl)-3-(1-oxopropylamino)-3,6-dihydro-2h-pyran-6-yl]acetic acid methyl ester  

Type

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

Broader concept

charge

  • 0

formula

  • C12H19NO5

inchi

  • InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9+,10-/m1/s1

inchikey

  • FSRWVHNAALREIT-KXUCPTDWSA-N

mass

  • 257.283

monoisotopicmass

  • 257.12632

smiles

  • CCC(=O)N[C@H]1C=C[C@@H](O[C@@H]1CO)CC(=O)OC

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:117931

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