CHEBI:2402 - acetophenazine dimaleate

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ChEBI Name acetophenazine dimaleate
ChEBI ID CHEBI:2402
Definition A maleate salt obtained by combining acetophenazine with two molar equivalents of maleic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
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Formulae C23H29N3O2S.2C4H4O4
C31H37N3O10S
Net Charge 0
Average Mass 643.70500
Monoisotopic Mass 643.21997
InChI InChI=1S/C23H29N3O2S.2C4H4O4/c1-18(28)19-7-8-23-21(17-19)26(20-5-2-3-6-22(20)29-23)10-4-9-24-11-13-25(14-12-24)15-16-27;2*5-3(6)1-2-4(7)8/h2-3,5-8,17,27H,4,9-16H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChIKey NUKVZKPNSKJGBK-SPIKMXEPSA-N
SMILES OC(=O)\C=C/C(O)=O.OC(=O)\C=C/C(O)=O.CC(=O)c1ccc2Sc3ccccc3N(CCCN3CCN(CCO)CC3)c2c1
Roles Classification
Application(s): phenothiazine antipsychotic drug

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ChEBI Ontology
Outgoing acetophenazine dimaleate (CHEBI:2402) has part acetophenazine (CHEBI:2401)
acetophenazine dimaleate (CHEBI:2402) has role phenothiazine antipsychotic drug (CHEBI:37930)
acetophenazine dimaleate (CHEBI:2402) is a maleate salt (CHEBI:50221)
IUPAC Name
1-(10-{3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl}-10H-phenothiazin-2-yl)ethanone di[(2Z)-but-2-enedioate]
Synonyms Sources
1-(2-hydroxyethyl)-4-(3-(2-acetyl-10-phenothiazinyl)propyl)piperazine dimaleate ChemIDplus
10-(3-(4-(2-hydroxyethyl)-1-piperazinyl)propyl)phenothiazin-2-yl methyl ketone dimaleate ChemIDplus
10-(3-(4-(2-hydroxyethyl)-1-piperazinyl)propyl)phenothiazin-2-yl methyl ketone maleate (1:2) (salt) ChemIDplus
2-acetyl-10-(3-(4-(β-hydroxyethyl)piperazinyl)propyl)phenothiazine dimaleate ChemIDplus
acetophenazine dimaleate ChemIDplus
acetophenazine maleate ChemIDplus
Tindal maleate ChemIDplus
Manual Xrefs Databases
Acetophenazine Wikipedia
D00788 KEGG DRUG
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Registry Numbers Types Sources
15340248 Reaxys Registry Number Reaxys
5714-00-1 CAS Registry Number KEGG COMPOUND
5714-00-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
14064235 PubMed citation Europe PMC
14212064 PubMed citation Europe PMC
Last Modified
23 January 2015