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CHEBI:188605 - 2-[4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]-1,3-benzoxazole

ChEBI IDCHEBI:188605
ChEBI Name2-[4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]-1,3-benzoxazole
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H18BNO3
Net Charge0
Average Mass307.158
Monoisotopic Mass307.13797
SMILESCC1(C)COB(c2ccc(-c3nc4ccccc4o3)cc2)OC1
InChIInChI=1S/C18H18BNO3/c1-18(2)11-21-19(22-12-18)14-9-7-13(8-10-14)17-20-15-5-3-4-6-16(15)23-17/h3-10H,11-12H2,1-2H3
InChIKeyRYOHAAGHIXCUGH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
2-[4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]-1,3-benzoxazole (CHEBI:188605) is a 1,3-oxazoles (CHEBI:46812)
IUPAC Name 
2-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]-1,3-benzoxazole
Manual XrefsDatabases
65326357ChemSpider