CHEBI:135390 - octabenzone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name octabenzone
ChEBI ID CHEBI:135390
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H26O3
Net Charge 0
Average Mass 326.430
Monoisotopic Mass 326.18819
InChI InChI=1S/C21H26O3/c1-2-3-4-5-6-10-15-24-18-13-14-19(20(22)16-18)21(23)17-11-8-7-9-12-17/h7-9,11-14,16,22H,2-6,10,15H2,1H3
InChIKey QUAMTGJKVDWJEQ-UHFFFAOYSA-N
SMILES C(=O)(C1=C(O)C=C(C=C1)OCCCCCCCC)C2=CC=CC=C2
ChEBI Ontology
Outgoing octabenzone (CHEBI:135390) is a benzophenones (CHEBI:22726)
Manual Xref Database
3392 DrugCentral
View more database links
Registry Number Type Source
1843-05-6 CAS Registry Number DrugCentral
Last Modified
23 February 2017