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2-hydroxy-4-[(1E)-3-oxoprop-1-en-1-yl]-2H-pyran-6-carboxylate

PropertiesImage
MNX_IDMNXM164134 Image of MNXM164134
referencemetacycM:CPD-18127
formulaC9H7O5
global charge-1
mol weight195.15
InChIKeyRBVIYJGRPOEJCS-OWOJBTEDSA-M
InChIInChI=1S/C9H8O5/c10-3-1-2-6-4-7(9(12)13)14-8(11)5-6/h1-5,8,11H,(H,12,13)/p-1/b2-1+
SMILESO=C/C=C/C1=CC(O)OC(C(=O)[O-])=C1
MNX internals
InChI (mnx)InChI=1/C9H8O5/c10-3-1-2-6-4-7(9(12)13)14-8(11)5-6/h1-5,8,11H,(H,12,13)/b2-1+/t8? Image of MNXM164134
SMILES (mnx)[CH:1](=[CH:2]/[C:6]1=[CH:5][CH:8]([OH:11])[O:14][C:7]([C:9]([OH:12])=[O:13])=[CH:4]1)\[CH:3]=[O:10]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-18127
metacycM:CPD-18127
seed.compound:cpd31710
seedM:cpd31710
RBVIYJGRPOEJCS-OWOJBTEDSA-M
2-hydroxy-4-[(1E)-3-oxoprop-1-en-1-yl]-2H-pyran-6-carboxylate

seedM:M_cpd31710
secondary/obsolete/fantasy identifier