CHEBI:118439 - 2-[(2R,3S,6S)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid

ChEBI IDCHEBI:118439
ChEBI Name2-[(2R,3S,6S)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid
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FormulaC12H20N2O5
Net Charge0
Average Mass272.301
Monoisotopic Mass272.13722
SMILESCC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)O)O[C@H]1CO
InChIInChI=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+/m1/s1
InChIKeyYHTHTGTWYCQHDQ-UTLUCORTSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(2R,3S,6S)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid (CHEBI:118439) is a pyrans (CHEBI:26407)
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LSM-29888LINCS