CHEBI:49071 - 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid
ChEBI ID CHEBI:49071
ChEBI ASCII Name 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C9H10O4
Net Charge 0
Average Mass 182.17330
Monoisotopic Mass 182.058
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)/t7-,9+/m0/s1
InChIKey AEUBLTTWYCDTGM-IONNQARKSA-N
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]acrylic acid (CHEBI:49071) is a 3-(cis-5,6-dihydroxycyclohexa-1,3-dienyl)acrylic acid (CHEBI:32328)
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)
3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid (CHEBI:49071) is enantiomer of 3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid (CHEBI:49070)
Incoming (E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid (CHEBI:61462) is a 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid (CHEBI:49071)
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)
3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid (CHEBI:49070) is enantiomer of 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid (CHEBI:49071)
IUPAC Name
3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dien-1-yl]prop-2-enoic acid
Last Modified
23 February 2011