CHEBI:60108 - 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate
ChEBI ID CHEBI:60108
ChEBI ASCII Name 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate
Definition The conjugate base of 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C9H9O4
Net Charge -1
Average Mass 181.16540
Monoisotopic Mass 181.050
InChI InChI=1S/C9H10O4/c10-7-3-1-2-6(9(7)13)4-5-8(11)12/h1-5,7,9-10,13H,(H,11,12)/p-1/t7-,9+/m0/s1
InChIKey AEUBLTTWYCDTGM-IONNQARKSA-M
SMILES [H]C(=C([H])C1=CC=C[C@H](O)[C@@H]1O)C([O-])=O
ChEBI Ontology
Outgoing 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate (CHEBI:60108) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate (CHEBI:60108) is conjugate base of 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid (CHEBI:49071)
Incoming (E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate (CHEBI:61451) is a 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate (CHEBI:60108)
3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid (CHEBI:49071) is conjugate acid of 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate (CHEBI:60108)
IUPAC Name
3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dien-1-yl]prop-2-enoate
Synonym Source
3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate anion ChEBI
Last Modified
24 August 2010