Chem
J-GLOBAL ID：200907065545500625
Nikkaji number：J2.177.242I
(2S)-2α,12β-Bis(tosyloxymethyl)-2,12-dimethyl-1,4,7,10,13,16-hexaoxacyclooctadecane
(2S)-2α,12β-ビス(トシルオキシメチル)-2,12-ジメチル-1,4,7,10,13,16-ヘキサオキサシクロオクタデカン
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： C30H44O12S2
Molecular formula furigana： C30-H44-O12-S2
Molecular weight： 660.790
InChI：
InChI=1S/C30H44O12S2/c1-25-5-9-27(10-6-25)43(31,32)41-23-29(3)21-37-15-13-35-14-16-38-22-30(4,40-20-18-36-17-19-39-29)24-42-44(33,34)28-11-7-26(2)8-12-28/h5-12H,13-24H2,1-4H3/t29-,30-/m0/s1
InChI key：
RJVBWNXACDZCDS-KYJUHHDHSA-N
SMILES：
Cc1ccc(cc1)S(=O)(=O)OC[C@]1(C)COCCOCCOC[C@@](C)(COS(=O)(=O)c2ccc(C)cc2)OCCOCCO1
Systematic name (3)：
- (2S)-2α,12β-ビス(トシルオキシメチル)-2,12-ジメチル-1,4,7,10,13,16-ヘキサオキサシクロオクタデカン
- [(2S,12S)-2,12-ジメチル-12-{[(4-メチルベンゼンスルホニル)オキシ]メチル}-1,4,7,10,13,16-ヘキサオキサシクロオクタデカン-2-イル]メチル 4-メチルベンゼン-1-スルホナート
- [(2S,12S)-2,12-dimethyl-12-{[(4-methylbenzenesulfonyl)oxy]methyl}-1,4,7,10,13,16-hexaoxacyclooctadecan-2-yl]methyl 4-methylbenzene-1-sulfonate
- (2S)-2α,12β-Bis(tosyloxymethyl)-2,12-dimethyl-1,4,7,10,13,16-hexaoxacyclooctadecane
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