Chem
J-GLOBAL ID：200907032563110162
Nikkaji number：J1.096.041J
Acetic acid (2S,3S)-2,3-dihydroxy-4-phenylbutyl ester
酢酸(2S,3S)-2,3-ジヒドロキシ-4-フェニルブチル
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： C12H16O4
Molecular formula furigana： C12-H16-O4
Molecular weight： 224.256
InChI：
InChI=1S/C12H16O4/c1-9(13)16-8-12(15)11(14)7-10-5-3-2-4-6-10/h2-6,11-12,14-15H,7-8H2,1H3/t11-,12-/m0/s1
InChI key：
LFRFPEGXRQOQQJ-RYUDHWBXSA-N
SMILES：
CC(=O)OC[C@H](O)[C@@H](O)Cc1ccccc1
Systematic name (3)：
- 酢酸(2S,3S)-2,3-ジヒドロキシ-4-フェニルブチル
- (2S,3S)-2,3-ジヒドロキシ-4-フェニルブチル アセタート
- (2S,3S)-2,3-dihydroxy-4-phenylbutyl acetate
- Acetic acid (2S,3S)-2,3-dihydroxy-4-phenylbutyl ester
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