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5-methylsalicylate

PropertiesImage
MNX_IDMNXM14919 Image of MNXM14919
referencechebi:231635
formulaC8H7O3
global charge-1
mol weight151.141
InChIKeyDLGBEGBHXSAQOC-UHFFFAOYSA-M
InChIInChI=1S/C8H8O3/c1-5-2-3-7(9)6(4-5)8(10)11/h2-4,9H,1H3,(H,10,11)/p-1
SMILESCC1=CC=C(O)C(C(=O)[O-])=C1
MNX internals
InChI (mnx)InChI=1/C8H8O3/c1-5-2-3-7(9)6(4-5)8(10)11/h2-4,9H,1H3,(H,10,11) Image of MNXM14919
SMILES (mnx)[CH3:1][C:5]1=[CH:4][C:6]([C:8](=[O:10])[OH:11])=[C:7]([OH:9])[CH:3]=[CH:2]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:231635
chebi:231635
DLGBEGBHXSAQOC-UHFFFAOYSA-M
5-methylsalicylate
2-hydroxy-5-methylbenzoate

metacyc.compound:CPD-10664
metacycM:CPD-10664
seed.compound:cpd22769
seedM:cpd22769
DLGBEGBHXSAQOC-UHFFFAOYSA-M
5-methylsalicylate

seedM:M_cpd22769
secondary/obsolete/fantasy identifier