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CHEBI:62057 - (E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate

ChEBI IDCHEBI:62057
ChEBI Name(E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate
Stars
ASCII Name(E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate
DefinitionA 3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate where the acrylic double bond has (E)-configuration.
Last Modified21 July 2011
SubmitterEugeni Belda
DownloadsMolfile
FormulaC9H9O4
Net Charge-1
Average Mass181.167
Monoisotopic Mass181.05063
SMILESO=C([O-])/C=C/C1=CC=C[C@@H](O)[C@H]1O
InChIInChI=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/b5-4+/t7-,9+/m1/s1
InChIKeyAEUBLTTWYCDTGM-HZMPTLLJSA-M
ChEBI Ontology
Outgoing Relation(s)
(E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate (CHEBI:62057) is a 3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate (CHEBI:60109)
(E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate (CHEBI:62057) is conjugate base of (E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid (CHEBI:62195)
Incoming Relation(s)
(E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid (CHEBI:62195) is conjugate acid of (E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate (CHEBI:62057)
IUPAC Name 
(2E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]prop-2-enoate
Synonyms  Source
(2E)-3-(5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoateSUBMITTER
cis-3-(3-carboxylatoethenyl)-3,5-cyclohexadiene-1,2-diolSUBMITTER
3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoateSUBMITTER
Manual XrefsDatabases
CPD-13034MetaCyc