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5-(3,4-dihydroxyphenyl)pentanoic acid

PropertiesImage
MNX_IDMNXM117230 Image of MNXM117230
referencechebi:137503
formulaC11H14O4
global charge0
mol weight210.229
InChIKeyKTDWBJGUMIZRHU-UHFFFAOYSA-N
InChIInChI=1S/C11H14O4/c12-9-6-5-8(7-10(9)13)3-1-2-4-11(14)15/h5-7,12-13H,1-4H2,(H,14,15)
SMILESO=C(O)CCCCC1=CC=C(O)C(O)=C1
MNX internals
InChI (mnx)InChI=1/C11H14O4/c12-9-6-5-8(7-10(9)13)3-1-2-4-11(14)15/h5-7,12-13H,1-4H2,(H,14,15) Image of MNXM117230
SMILES (mnx)[CH2:1]([CH2:2][CH2:4][C:11](=[O:14])[OH:15])[CH2:3][C:8]1=[CH:7][C:10]([OH:13])=[C:9]([OH:12])[CH:6]=[CH:5]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:137503
chebi:137503
KTDWBJGUMIZRHU-UHFFFAOYSA-N
5-(3,4-dihydroxyphenyl)pentanoic acid
hmdb:HMDB0029233
KTDWBJGUMIZRHU-UHFFFAOYSA-N
3,4-Dihydroxyphenylvaleric acid
3,4-Dihydroxyphenylvalerate
5-(3',4'-Dihydroxyphenyl)-valeric acid
5-(3,4-Dihydroxyphenyl) valerate
5-(3,4-dihydroxyphenyl)pentanoic acid

envipath:...163996851a32
envipathM:...163996851a32
KTDWBJGUMIZRHU-UHFFFAOYSA-M
compound 0074075

hmdb:HMDB29233
secondary/obsolete/fantasy identifier