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ChEBI
> Main
CHEBI:31862 - Monatepil maleate
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ChEBI Ontology
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ChEBI Name
Monatepil maleate
ChEBI ID
CHEBI:31862
Stars
This entity has been manually annotated by a third party.
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Formulae
C28H30FN3OS.C4H4O4
C32H34FN3O5S
Net Charge
0
Average Mass
591.695
Monoisotopic Mass
591.22032
InChI
InChI=1S/C28H30FN3OS.C4H4O4/c29-
22-
11-
13-
23(14-
12-
22)
32-
18-
16-
31(17-
19-
32)
15-
5-
10-
27(33)
30-
28-
24-
7-
2-
1-
6-
21(24)
20-
34-
26-
9-
4-
3-
8-
25(26)
28;5-
3(6)
1-
2-
4(7)
8/h1-
4,6-
9,11-
14,28H,5,10,15-
20H2,(H,30,33)
;1-
2H,(H,5,6)
(H,7,8)
/b;2-
1-
InChIKey
ZDZXCYHMVFLGMT-BTJKTKAUSA-N
SMILES
C1(C2=C(CSC3=C1C=CC=C3)C=CC=C2)NC(=O)CCCN4CCN(CC4)C5=CC=C(C=C5)F.C(/C=C\C(O)=O)(O)=O
ChEBI Ontology
Outgoing
Monatepil maleate (
CHEBI:31862
)
is a
dibenzothiepine (
CHEBI:38924
)
Synonym
Source
Monatepil maleate
KEGG COMPOUND
Manual Xref
Database
D01171
KEGG DRUG
View more database links
Registry Number
Type
Source
132046-06-1
CAS Registry Number
KEGG COMPOUND
Last Modified
06 March 2017