Chem
J-GLOBAL ID:200907049907832685
Nikkaji number:J1.895.309I
BAY-58-2667
BAY-58-2667
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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:
C36 H39 NO5
Molecular formula furigana:
C36-H39-N-O5
Molecular weight:
565.710
InChI:
InChI=1S/C36H39NO5/c38-35(39)12-6-7-24-37(26-30-19-21-33(22-20-30)36(40)41)25-23-32-10-4-5-11-34(32)42-27-31-17-15-29(16-18-31)14-13-28-8-2-1-3-9-28/h1-5,8-11,15-22H,6-7,12-14,23-27H2,(H,38,39)(H,40,41)
InChI key:
WPYWMXNXEZFMAK-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCN(CCc1ccccc1OCc1ccc(CCc2ccccc2)cc1)Cc1ccc(cc1)C(=O)O
Systematic name (4):
5-[[2-[2-(4-フェネチルベンジルオキシ)フェニル]エチル](4-カルボキシベンジル)アミノ]ペンタン酸
4-[[(4-カルボキシブチル)[2-[2-[[4-(2-フェニルエチル)ベンジル]オキシ]フェニル]エチル]アミノ]メチル]安息香酸
4-{[(4-カルボキシブチル)[2-(2-{[4-(2-フェニルエチル)フェニル]メトキシ}フェニル)エチル]アミノ]メチル}安息香酸
4-{[(4-carboxybutyl)[2-(2-{[4-(2-phenylethyl)phenyl]methoxy}phenyl)ethyl]amino]methyl}benzoic acid
Other name (6):
5-[[2-[2-(4-Phenethylbenzyloxy)phenyl]ethyl](4-carboxybenzyl)amino]pentanoic acid
BAY 58-2667
4-[[(4-Carboxybutyl)[2-[2-[[4-(2-phenylethyl)benzyl]oxy]phenyl]ethyl]amino]methyl]benzoic acid
BAY-58-2667
シナシグアト
Cinaciguat
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CAS registry number:
329773-35-5
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