CHEBI:175993 - Glycerol tribenzoate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Glycerol tribenzoate
ChEBI ID CHEBI:175993
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C24H20O6
Net Charge 0
Average Mass 404.418
Monoisotopic Mass 404.12599
InChI InChI=1S/C24H20O6/c25-22(18-10-4-1-5-11-18)28-16-21(30-24(27)20-14-8-3-9-15-20)17-29-23(26)19-12-6-2-7-13-19/h1-15,21H,16-17H2
InChIKey HIZCTWCPHWUPFU-UHFFFAOYSA-N
SMILES O(C(COC(=O)C1=CC=CC=C1)COC(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3
ChEBI Ontology
Outgoing Glycerol tribenzoate (CHEBI:175993) is a benzoate ester (CHEBI:36054)
IUPAC Name
2,3-dibenzoyloxypropyl benzoate
Manual Xrefs Databases
55103 ChemSpider
HMDB0029556 HMDB
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Registry Number Type Source
614-33-5 CAS Registry Number ChemIDplus