Chem
J-GLOBAL ID:200907000672484987
Nikkaji number:J734.972F
U-94614
4-[4-[4-(1,1-ジメチル-2-ヒドロキシエチル)フェニル]-2-ヒドロキシブトキシ]安息香酸
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C21 H26 O5
Molecular formula furigana:
C21-H26-O5
Molecular weight:
358.434
InChI:
InChI=1S/C21H26O5/c1-21(2,14-22)17-8-3-15(4-9-17)5-10-18(23)13-26-19-11-6-16(7-12-19)20(24)25/h3-4,6-9,11-12,18,22-23H,5,10,13-14H2,1-2H3,(H,24,25)
InChI key:
JRKJQDAXCKBCBB-UHFFFAOYSA-N
SMILES:
CC(C)(CO)c1ccc(CCC(O)COc2ccc(cc2)C(=O)O)cc1
Systematic name (3):
4-[4-[4-(1,1-ジメチル-2-ヒドロキシエチル)フェニル]-2-ヒドロキシブトキシ]安息香酸
4-{2-ヒドロキシ-4-[4-(1-ヒドロキシ-2-メチルプロパン-2-イル)フェニル]ブトキシ}安息香酸
4-{2-hydroxy-4-[4-(1-hydroxy-2-methylpropan-2-yl)phenyl]butoxy}benzoic acid
Other name (2):
U-94614
4-[4-[4-(1,1-Dimethyl-2-hydroxyethyl)phenyl]-2-hydroxybutoxy]benzoic acid
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