CHEBI:92716 - 2-[4-[3-[3-hydroxy-4-(2-oxoethyl)-2-propylphenoxy]propoxy]phenoxy]acetic acid

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ChEBI Name 2-[4-[3-[3-hydroxy-4-(2-oxoethyl)-2-propylphenoxy]propoxy]phenoxy]acetic acid
ChEBI ID CHEBI:92716
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/c1-2-4-19-20(10-5-16(11-12-23)22(19)26)28-14-3-13-27-17-6-8-18(9-7-17)29-15-21(24)25/h5-10,12,26H,2-4,11,13-15H2,1H3,(H,24,25)
InChIKey YBEZORYMVISYOA-UHFFFAOYSA-N
SMILES CCCC1=C(C=CC(=C1O)CC=O)OCCCOC2=CC=C(C=C2)OCC(=O)O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 2-[4-[3-[3-hydroxy-4-(2-oxoethyl)-2-propylphenoxy]propoxy]phenoxy]acetic acid (CHEBI:92716) is a monocarboxylic acid (CHEBI:25384)
Manual Xref Database
LSM-2901 LINCS
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