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Examples:
iron*
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InChI=1S/CH4O/c1-2/h2H,1H3
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caffeine
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ChEBI
> Main
CHEBI:135540 - alkofanone
Main
ChEBI Ontology
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ChEBI Name
alkofanone
ChEBI ID
CHEBI:135540
Stars
This entity has been manually annotated by a third party.
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Formula
C21H19NO3S
Net Charge
0
Average Mass
365.447
Monoisotopic Mass
365.10856
InChI
InChI=1S/C21H19NO3S/c22-
18-
11-
13-
19(14-
12-
18)
26(24,25)
21(17-
9-
5-
2-
6-
10-
17)
15-
20(23)
16-
7-
3-
1-
4-
8-
16/h1-
14,21H,15,22H2
InChIKey
VWEMSUCCUQSLME-UHFFFAOYSA-N
SMILES
C(S(=O)(=O)C1=CC=C(C=C1)N)(CC(=O)C2=CC=CC=C2)C3=CC=CC=C3
ChEBI Ontology
Outgoing
alkofanone (
CHEBI:135540
)
is a
dihydrochalcones (
CHEBI:71230
)
Synonyms
Sources
alfone
DrugCentral
clafanone
DrugCentral
Manual Xref
Database
121
DrugCentral
View more database links
Registry Number
Type
Source
7527-94-8
CAS Registry Number
DrugCentral
Last Modified
23 February 2017