CHEBI:94812 - 2-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy]acetic acid

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ChEBI Name 2-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy]acetic acid
ChEBI ID CHEBI:94812
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H26O7
Net Charge 0
Average Mass 402.438
Monoisotopic Mass 402.16785
InChI InChI=1S/C22H26O7/c1-3-5-19-20(11-10-18(15(2)23)22(19)26)28-13-4-12-27-16-6-8-17(9-7-16)29-14-21(24)25/h6-11,26H,3-5,12-14H2,1-2H3,(H,24,25)
InChIKey HBBVCKCCQCQCTJ-UHFFFAOYSA-N
SMILES CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=CC=C(C=C2)OCC(=O)O
ChEBI Ontology
Outgoing 2-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy]acetic acid (CHEBI:94812) is a aromatic ketone (CHEBI:76224)
Manual Xref Database
LSM-6012 LINCS
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