CHEBI:28957 - 3,6-dichloro-cis-cyclohexa-3,5-diene-1,2-diol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3,6-dichloro-cis-cyclohexa-3,5-diene-1,2-diol
ChEBI ID CHEBI:28957
ChEBI ASCII Name 3,6-dichloro-cis-cyclohexa-3,5-diene-1,2-diol
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:1414, CHEBI:19915
Supplier Information
Download Molfile XML SDF
Formula C6H6Cl2O2
Net Charge 0
Average Mass 181.01604
Monoisotopic Mass 179.97448
InChI InChI=1S/C6H6Cl2O2/c7-3-1-2-4(8)6(10)5(3)9/h1-2,5-6,9-10H/t5-,6+
InChIKey NPONHQROCKGAME-OLQVQODUSA-N
SMILES O[C@H]1[C@@H](O)C(Cl)=CC=C1Cl
ChEBI Ontology
Outgoing 3,6-dichloro-cis-cyclohexa-3,5-diene-1,2-diol (CHEBI:28957) has functional parent cis-cyclohexa-3,5-diene-1,2-diol (CHEBI:16190)
3,6-dichloro-cis-cyclohexa-3,5-diene-1,2-diol (CHEBI:28957) is a organochlorine compound (CHEBI:36683)
IUPAC Name
rel-(1R,2S)-3,6-dichlorocyclohexa-3,5-diene-1,2-diol
Synonyms Sources
(1R,2S)-3,6-dichlorocyclohexa-3,5-diene-1,2-diol IUPAC
3,6-Dichloro-cis-1,2-dihydroxycyclohexa-3,5-diene KEGG COMPOUND
Manual Xrefs Databases
c0592 UM-BBD
C07093 KEGG COMPOUND
View more database links
Last Modified
04 August 2014