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Concept information

organooxygen compound > oxacycle > pyrans > 2-[(2s,3s,6r)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2h-pyran-6-yl]acetic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > 2-[(2s,3s,6r)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2h-pyran-6-yl]acetic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > 2-[(2s,3s,6r)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2h-pyran-6-yl]acetic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > 2-[(2s,3s,6r)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2h-pyran-6-yl]acetic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyrans > 2-[(2s,3s,6r)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2h-pyran-6-yl]acetic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyrans > 2-[(2s,3s,6r)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2h-pyran-6-yl]acetic acid

Preferred term

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

Type

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

Broader concept

charge

  • 0

formula

  • C12H20N2O5

inchi

  • InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9-,10+/m0/s1

inchikey

  • YHTHTGTWYCQHDQ-LPEHRKFASA-N

mass

  • 272.298

monoisotopicmass

  • 272.13722

smiles

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

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:118381

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