Chem
J-GLOBAL ID：200907000732844694
Nikkaji number：J967.623F
5,5′-(1,4-Phenylenebisoxy)bis[(S)-4-methyl-3-oxavaleric acid]
5,5′-(1,4-フェニレンビスオキシ)ビス[(S)-4-メチル-3-オキサ吉草酸]
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
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
Molecular formula： C16H22O8
Molecular formula furigana： C16-H22-O8
Molecular weight： 342.344
InChI：
InChI=1S/C16H22O8/c1-11(21-9-15(17)18)7-23-13-3-5-14(6-4-13)24-8-12(2)22-10-16(19)20/h3-6,11-12H,7-10H2,1-2H3,(H,17,18)(H,19,20)/t11-,12-/m0/s1
InChI key：
AKCLUBKQRYCJKR-RYUDHWBXSA-N
SMILES：
C[C@@H](COc1ccc(OC[C@H](C)OCC(=O)O)cc1)OCC(=O)O
Systematic name (3)：
- 5,5′-(1,4-フェニレンビスオキシ)ビス[(S)-4-メチル-3-オキサ吉草酸]
- 2-{[(2S)-1-{4-[(2S)-2-(カルボキシメトキシ)プロポキシ]フェノキシ}プロパン-2-イル]オキシ}酢酸
- 2-{[(2S)-1-{4-[(2S)-2-(carboxymethoxy)propoxy]phenoxy}propan-2-yl]oxy}acetic acid
- 5,5′-(1,4-Phenylenebisoxy)bis[(S)-4-methyl-3-oxavaleric acid]
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