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Concept information

organooxygen compound > oxacycle > pyrans > 6-hydroxy-5-methoxy-3-methyl-3, 6-dihydro-2h-pyran-4-carboxylic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > 6-hydroxy-5-methoxy-3-methyl-3, 6-dihydro-2h-pyran-4-carboxylic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > 6-hydroxy-5-methoxy-3-methyl-3, 6-dihydro-2h-pyran-4-carboxylic acid

Preferred term

6-hydroxy-5-methoxy-3-methyl-3, 6-dihydro-2h-pyran-4-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C8H12O5

inchi

  • InChI=1S/C8H12O5/c1-4-3-13-8(11)6(12-2)5(4)7(9)10/h4,8,11H,3H2,1-2H3,(H,9,10)/t4-,8-/m1/s1

inchikey

  • TXMKZYZATZZMPU-SPGJFGJESA-N

mass

  • 188.179

monoisotopicmass

  • 188.06847

smiles

  • O=C(O)C1=C(OC)[C@@H](OC[C@H]1C)O

subset

  • 2_STAR

synonym EXACT

  • (3S,6R)-6-hydroxy-5-methoxy-3-methyl-3,6-dihydro-2H-pyran-4-carboxylic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210312

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