Chem
J-GLOBAL ID:201007027662579579
Nikkaji number:J2.888.179G
SB-751689
ロナカレレット
Download MOL file
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:
C25 H31 F2 NO4
Molecular formula furigana:
C25-H31-F2-N-O4
Molecular weight:
447.523
InChI:
InChI=1S/C25H31F2NO4/c1-25(2,13-17-9-18-5-3-4-6-19(18)10-17)28-14-20(29)15-32-22-12-16(7-8-23(30)31)11-21(26)24(22)27/h3-6,11-12,17,20,28-29H,7-10,13-15H2,1-2H3,(H,30,31)
InChI key:
FQJISUPNMFRIFZ-UHFFFAOYSA-N
SMILES:
CC(C)(CC1Cc2ccccc2C1)NCC(O)COc1cc(CCC(=O)O)cc(F)c1F
Systematic name (4):
3-[3-[2-ヒドロキシ-3-[1,1-ジメチル-2-(インダン-2-イル)エチルアミノ]プロポキシ]-4,5-ジフルオロフェニル]プロピオン酸
3,4-ジフルオロ-5-[2-ヒドロキシ-3-[2-(2-インダニル)-1,1-ジメチルエチルアミノ]プロポキシ]ベンゼンプロピオン酸
3-[3-(3-{[1-(2,3-ジヒドロ-1H-インデン-2-イル)-2-メチルプロパン-2-イル]アミノ}-2-ヒドロキシプロポキシ)-4,5-ジフルオロフェニル]プロパン酸
3-[3-(3-{[1-(2,3-dihydro-1H-inden-2-yl)-2-methylpropan-2-yl]amino}-2-hydroxypropoxy)-4,5-difluorophenyl]propanoic acid
Other name (5):
3-[3-[2-Hydroxy-3-[1,1-dimethyl-2-(indan-2-yl)ethylamino]propoxy]-4,5-difluorophenyl]propionic acid
ロナカレレット
Ronacaleret
3,4-Difluoro-5-[2-hydroxy-3-[2-(2-indanyl)-1,1-dimethylethylamino]propoxy]benzenepropionic acid
SB-751689
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