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4,6-dihydroxy-2-(hydroxymethyl)-3,5-dimethylbenzoate

PropertiesImage
MNX_IDMNXM147808 Image of MNXM147808
referencechebi:232429
formulaC10H11O5
global charge-1
mol weight211.193
InChIKeyWDDYGGTZWBBVIB-UHFFFAOYSA-M
InChIInChI=1S/C10H12O5/c1-4-6(3-11)7(10(14)15)9(13)5(2)8(4)12/h11-13H,3H2,1-2H3,(H,14,15)/p-1
SMILESCC1=C(O)C(C)=C(O)C(C(=O)[O-])=C1CO
MNX internals
InChI (mnx)InChI=1/C10H12O5/c1-4-6(3-11)7(10(14)15)9(13)5(2)8(4)12/h11-13H,3H2,1-2H3,(H,14,15) Image of MNXM147808
SMILES (mnx)[CH3:1][C:4]1=[C:6]([CH2:3][OH:11])[C:7]([C:10](=[O:14])[OH:15])=[C:9]([OH:13])[C:5]([CH3:2])=[C:8]1[OH:12]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:232429
chebi:232429
WDDYGGTZWBBVIB-UHFFFAOYSA-M
4,6-dihydroxy-2-(hydroxymethyl)-3,5-dimethylbenzoate
4,6-dihydroxy-2-(hydroxymethyl)-3,5-dimethylbenzoate(1-)

metacyc.compound:CPD-17318
metacycM:CPD-17318
seed.compound:cpd34247
seedM:cpd34247
WDDYGGTZWBBVIB-UHFFFAOYSA-M
4,6-dihydroxy-2-(hydroxymethyl)-3,5-dimethylbenzoate

seedM:M_cpd34247
secondary/obsolete/fantasy identifier