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InChI=1S/CH4O/c1-2/h2H,1H3
,
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ChEBI
> Main
CHEBI:134742 - delamanid
Main
ChEBI Ontology
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ChEBI Name
delamanid
ChEBI ID
CHEBI:134742
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C25H25F3N4O6
Net Charge
0
Average Mass
534.485
Monoisotopic Mass
534.17262
InChI
InChI=1S/C25H25F3N4O6/c1-
24(15-
31-
14-
22(32(33)
34)
29-
23(31)
38-
24)
16-
35-
18-
4-
2-
17(3-
5-
18)
30-
12-
10-
20(11-
13-
30)
36-
19-
6-
8-
21(9-
7-
19)
37-
25(26,27)
28/h2-
9,14,20H,10-
13,15-
16H2,1H3/t24-
/m1/s1
InChIKey
XDAOLTSRNUSPPH-XMMPIXPASA-N
SMILES
C(OC1=CC=C(N2CCC(OC3=CC=C(OC(F)(F)F)C=C3)CC2)C=C1)[C@@]4(C)CN5C(=NC([N+]([O-])=O)=C5)O4
ChEBI Ontology
Outgoing
delamanid (
CHEBI:134742
)
is a
piperidines (
CHEBI:26151
)
Synonyms
Sources
deltyba
DrugCentral
OPC-67683
DrugCentral
Manual Xref
Database
4819
DrugCentral
View more database links
Registry Number
Type
Source
681492-22-8
CAS Registry Number
DrugCentral
Last Modified
23 February 2017