CHEBI:46743 - (1S,2S)-DDT-2,3-dihydrodiol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (1S,2S)-DDT-2,3-dihydrodiol
ChEBI ID CHEBI:46743
ChEBI ASCII Name (1S,2S)-DDT-2,3-dihydrodiol
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:23280, CHEBI:10465
Supplier Information
Download Molfile XML SDF
Formula C14H11Cl5O2
Net Charge 0
Average Mass 388.49944
Monoisotopic Mass 385.92017
InChI InChI=1S/C14H11Cl5O2/c15-8-3-1-7(2-4-8)11(14(17,18)19)9-5-6-10(16)13(21)12(9)20/h1-6,11-13,20-21H/t11?,12-,13+/m0/s1
InChIKey GSABQSGIWIDCHM-LWNNLKQOSA-N
SMILES O[C@H]1[C@@H](O)C(=CC=C1Cl)C(c1ccc(Cl)cc1)C(Cl)(Cl)Cl
ChEBI Ontology
Outgoing (1S,2S)-DDT-2,3-dihydrodiol (CHEBI:46743) is a DDT-2,3-dihydrodiol (CHEBI:46744)
IUPAC Name
(1S,2S)-3-chloro-6-[2,2,2-trichloro-1-(4-chlorophenyl)ethyl]cyclohexa-3,5-diene-1,2-diol
Synonyms Sources
cis-2,3-Dihydrodiol 1,1,1-Trichloro-2,2-bis(4'-chlorophenyl)ethane KEGG COMPOUND
cis-2,3-Dihydrodiol DDT KEGG COMPOUND
Manual Xrefs Databases
c0419 UM-BBD
C06649 KEGG COMPOUND
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Last Modified
02 October 2007