CHEBI:149551 - emetine dihydrochloride

ChEBI IDCHEBI:149551
ChEBI Nameemetine dihydrochloride
Stars
DefinitionThe dihydrochloride salt of emetine.
Last Modified23 April 2020
SubmitterAdnan
DownloadsMolfile
FormulaC29H40N2O4.2HCl
Net Charge0
Average Mass553.571
Monoisotopic Mass552.25216
SMILESCl.Cl.[H][C@]1(C[C@@]2([H])NCCc3cc(OC)c(OC)cc32)C[C@@]2([H])c3cc(OC)c(OC)cc3CCN2C[C@@H]1CC
InChIInChI=1S/C29H40N2O4.2ClH/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24;;/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3;2*1H/t18-,21-,24+,25-;;/m0../s1
InChIKeyJROGBPMEKVAPEH-GXGBFOEMSA-N
Roles Classification
Biological Roles:
anticoronaviral agent  Any antiviral agent which inhibits the activity of coronaviruses.
protein synthesis inhibitor  A compound, usually an anti-bacterial agent or a toxin, which inhibits the synthesis of a protein.
antiviral agent  A substance that destroys or inhibits replication of viruses.
autophagy inhibitor  Any compound that inhibits the process of autophagy (the self-digestion of one or more components of a cell through the action of enzymes originating within the same cell).
antimalarial  A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
antiprotozoal drug  Any antimicrobial drug which is used to treat or prevent protozoal infections.
Applications:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
antimalarial  A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
antiprotozoal drug  Any antimicrobial drug which is used to treat or prevent protozoal infections.
emetic  Any agent that induces nausea and vomiting.
ChEBI Ontology
Outgoing Relation(s)
emetine dihydrochloride (CHEBI:149551) has part emetine(2+) (CHEBI:149548)
emetine dihydrochloride (CHEBI:149551) has role anticoronaviral agent (CHEBI:149553)
emetine dihydrochloride (CHEBI:149551) has role antimalarial (CHEBI:38068)
emetine dihydrochloride (CHEBI:149551) has role antineoplastic agent (CHEBI:35610)
emetine dihydrochloride (CHEBI:149551) has role antiprotozoal drug (CHEBI:35820)
emetine dihydrochloride (CHEBI:149551) has role antiviral agent (CHEBI:22587)
emetine dihydrochloride (CHEBI:149551) has role autophagy inhibitor (CHEBI:88230)
emetine dihydrochloride (CHEBI:149551) has role emetic (CHEBI:149552)
emetine dihydrochloride (CHEBI:149551) has role protein synthesis inhibitor (CHEBI:48001)
emetine dihydrochloride (CHEBI:149551) is a hydrochloride (CHEBI:36807)
Incoming Relation(s)
emetine dihydrochloride hydrate (CHEBI:146000) has part emetine dihydrochloride (CHEBI:149551)
IUPAC Name 
(2S)-6',7',10,11-tetramethoxyemetan dihydrochloride
Synonyms  Source
emetine HClChemIDplus
emetine hydrochlorideChemIDplus
emetine dihydrochloride anhydrousChEBI
Manual XrefsDatabases
D03985KEGG DRUG
Registry NumbersSources
CAS:316-42-7ChemIDplus
Citations