Chem
J-GLOBAL ID:201707017893383266
Nikkaji number:J3.606.057C
(4R,5S)-4-(p-Tolylsulfonyl)-5-(4-methoxyphenyl)-5-phenylvaleric acid methyl ester
(4R,5S)-4-(p-トリルスルホニル)-5-(4-メトキシフェニル)-5-フェニル吉草酸メチル
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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:
C26 H28 O5 S
Molecular formula furigana:
C26-H28-O5-S
Molecular weight:
452.570
InChI:
InChI=1S/C26H28O5S/c1-19-9-15-23(16-10-19)32(28,29)24(17-18-25(27)31-3)26(20-7-5-4-6-8-20)21-11-13-22(30-2)14-12-21/h4-16,24,26H,17-18H2,1-3H3/t24-,26+/m1/s1
InChI key:
SURPYBLBTUYHJU-RSXGOPAZSA-N
SMILES:
COC(=O)CC[C@H]([C@@H](c1ccccc1)c1ccc(OC)cc1)S(=O)(=O)c1ccc(C)cc1
Systematic name (3):
(4R,5S)-4-(p-トリルスルホニル)-5-(4-メトキシフェニル)-5-フェニル吉草酸メチル
メチル (4R,5S)-5-(4-メトキシフェニル)-4-(4-メチルベンゼンスルホニル)-5-フェニルペンタノアート
methyl (4R,5S)-5-(4-methoxyphenyl)-4-(4-methylbenzenesulfonyl)-5-phenylpentanoate
Other name (1):
(4R,5S)-4-(p-Tolylsulfonyl)-5-(4-methoxyphenyl)-5-phenylvaleric acid methyl ester
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