CHEBI:125412 - 1-(3-hydroxy-4-methoxyphenyl)ethane-1,2-diol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-(3-hydroxy-4-methoxyphenyl)ethane-1,2-diol
ChEBI ID CHEBI:125412
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C9H12O4
Net Charge 0
Average Mass 184.190
Monoisotopic Mass 184.07356
InChI InChI=1S/C9H12O4/c1-13-9-3-2-6(4-7(9)11)8(12)5-10/h2-4,8,10-12H,5H2,1H3
InChIKey FBDKAIYPFAFJHV-UHFFFAOYSA-N
SMILES COC1=C(C=C(C=C1)C(CO)O)O
ChEBI Ontology
Outgoing 1-(3-hydroxy-4-methoxyphenyl)ethane-1,2-diol (CHEBI:125412) is a methoxybenzenes (CHEBI:51683)
1-(3-hydroxy-4-methoxyphenyl)ethane-1,2-diol (CHEBI:125412) is a phenols (CHEBI:33853)
Manual Xrefs Databases
HMDB0035056 HMDB
LSM-36898 LINCS
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