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The Swiss Initiative in Systems Biology

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chloral hydrate

Properties

Image

Occurences in reactions

MNX_ID

MNXM5666

Image of MNXM5666

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

formula

C₂H₃Cl₃O₂

charge

0

mass

163.91986

reference

InChIKey

RNFNDJAIBTYOQL-UHFFFAOYSA-N

InChI

InChI=1S/C2H3Cl3O2/c3-2(4,5)1(6)7/h1,6-7H

SMILES

OC(O)C(Cl)(Cl)Cl

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:28142 chebi:28142	chloral hydrate 1,1,1-trichloro-2,2-dihydroxyethane 1,1,1-trichloro-2,2-ethanediol 2,2,2-trichloro-1,1-ethanediol 2,2,2-trichloroethane-1,1-diol Aquachloral Supprettes Chloral hydrate Chloralhydrat Noctec Somnote Trichloracetaldehyd-hydrat chloral monohydrate knockout drops trichloroacetaldehyde hydrate
sabiork.compound:9022 sabiorkM:9022 envipath:...aa786b3243f0 envipathM:...aa786b3243f0 kegg.compound:C06899 keggC:C06899	Chloral hydrate
kegg.drug:D00265 keggD:D00265	Chloral hydrate (JP18/USP) Noctec (TN)
hmdb:HMDB0060451	Chloral hydrate 1,1,1-Trichloro-2,2-dihydroxyethane 1,1,1-Trichloro-2,2-ethanediol 2,2,2-Trichloro-1,1-ethanediol 2,2,2-trichloroethane-1,1-diol Aquachloral supprettes Chloral hydric acid Chloral monohydrate Chloral monohydric acid Chloralhydrat Hydrate, chloral Knockout drops Noctec Somnote Trichloracetaldehyd-hydrat Trichloroacetaldehyde hydrate Trichloroacetaldehyde hydric acid chloral hydrate
seed.compound:cpd04248 seedM:cpd04248	Chloral hydrate chloral hydrate
metacyc.compound:CPD0-1476 metacycM:CPD0-1476	chloral hydrate
hmdb:HMDB60451 chebi:23105 chebi:3600 keggC:M_C06899 keggD:M_D00265 seedM:M_cpd04248	secondary/obsolete/fantasy identifier