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(1S,2S)-DDT-2,3-dihydrodiol

Properties

Image

Occurences in reactions

MNX_ID

MNXM4161

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	3

formula

C₁₄H₁₁Cl₅O₂

charge

mass

385.92017

reference

InChIKey

GSABQSGIWIDCHM-LWNNLKQOSA-N

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

SMILES

O[C@@H]1C(Cl)=CC=C(C(c2ccc(Cl)cc2)C(Cl)(Cl)Cl)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:46743 chebi:46743	(1S,2S)-DDT-2,3-dihydrodiol (1S,2S)-3-chloro-6-[2,2,2-trichloro-1-(4-chlorophenyl)ethyl]cyclohexa-3,5-diene-1,2-diol cis-2,3-Dihydrodiol 1,1,1-Trichloro-2,2-bis(4'-chlorophenyl)ethane cis-2,3-Dihydrodiol DDT
kegg.compound:C06649 keggC:C06649	cis-2,3-Dihydrodiol 1,1,1-Trichloro-2,2-bis(4'-chlorophenyl)ethane cis-2,3-Dihydrodiol DDT
envipath:...c07fd3b7ab76 envipathM:...c07fd3b7ab76	cis-2,3-Dihydrodiol DDT
seed.compound:cpd04053 seedM:cpd04053	cis-2,3-Dihydrodiol DDT cis-2,3-Dihydrodiol 1,1,1-Trichloro-2,2-bis(4'-chlorophenyl)ethane
chebi:10465 chebi:23280 keggC:M_C06649 seedM:M_cpd04053	secondary/obsolete/fantasy identifier