CHEBI:135540 - alkofanone

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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