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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:32259 - trifluoperazine dimaleate
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ChEBI Ontology
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ChEBI Name
trifluoperazine dimaleate
ChEBI ID
CHEBI:32259
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C21H24F3N3S.(C4H4O4)2
Net Charge
0
Average Mass
639.64101
Monoisotopic Mass
639.18622
InChI
InChI=1S/C21H24F3N3S.2C4H4O4/c1-
25-
11-
13-
26(14-
12-
25)
9-
4-
10-
27-
17-
5-
2-
3-
6-
19(17)
28-
20-
8-
7-
16(15-
18(20)
27)
21(22,23)
24;2*5-
3(6)
1-
2-
4(7)
8/h2-
3,5-
8,15H,4,9-
14H2,1H3;2*1-
2H,(H,5,6)
(H,7,8)
/b;2*2-
1-
InChIKey
WTMXVVQBBRYSLL-SPIKMXEPSA-N
SMILES
[H+]
.[H+]
.[H+]
.[H+]
.[O-
]
C(=O)
\C=C/C([O-
]
)
=O.[O-
]
C(=O)
\C=C/C([O-
]
)
=O.CN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)
C(F)
(F)
F)
CC1
ChEBI Ontology
Outgoing
trifluoperazine dimaleate (
CHEBI:32259
)
has part
trifluoperazine (
CHEBI:45951
)
trifluoperazine dimaleate (
CHEBI:32259
)
is a
maleate salt (
CHEBI:50221
)
IUPAC Name
10-
[3-
(4-
methylpiperazin-
1-
yl)propyl]-
2-
(trifluoromethyl)-
10
H
-
phenothiazine di[(2
Z
)-
but-
2-
enedioic acid]
Manual Xrefs
Databases
D01448
KEGG DRUG
DB00831
DrugBank
View more database links
Registry Numbers
Types
Sources
3873091
Beilstein Registry Number
Beilstein
605-75-4
CAS Registry Number
ChemIDplus
Last Modified
21 January 2009