Chem
J-GLOBAL ID:200907079911928065
Nikkaji number:J1.464.479B
(1S,3aβ)-4-(Phenylsulfonyl)-4-[4-methyl-4-(triethylsiloxy)pentyl]-7aα-methylhydrindane-1α-acetic acid
(1S,3aβ)-4-(フェニルスルホニル)-4-[4-メチル-4-(トリエチルシロキシ)ペンチル]-7aα-メチルヒドリンダン-1α-酢酸
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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:
C30 H50 O5 SSi
Molecular formula furigana:
C30-H50-O5-S-SI
Molecular weight:
550.870
InChI:
InChI=1S/C30H50O5SSi/c1-7-37(8-2,9-3)35-28(4,5)19-13-21-30(36(33,34)25-15-11-10-12-16-25)22-14-20-29(6)24(23-27(31)32)17-18-26(29)30/h10-12,15-16,24,26H,7-9,13-14,17-23H2,1-6H3,(H,31,32)/t24-,26-,29-,30?/m0/s1
InChI key:
NRUBBDYIZZBJKX-QIVROETBSA-N
SMILES:
CC[Si](CC)(CC)OC(C)(C)CCCC1(CCC[C@@]2(C)[C@H](CC(=O)O)CC[C@H]12)S(=O)(=O)c1ccccc1
Systematic name (3):
(1S,3aβ)-4-(フェニルスルホニル)-4-[4-メチル-4-(トリエチルシロキシ)ペンチル]-7aα-メチルヒドリンダン-1α-酢酸
2-[(1S,3aS,7aS)-4-(ベンゼンスルホニル)-7a-メチル-4-{4-メチル-4-[(トリエチルシリル)オキシ]ペンチル}-オクタヒドロ-1H-インデン-1-イル]酢酸
2-[(1S,3aS,7aS)-4-(benzenesulfonyl)-7a-methyl-4-{4-methyl-4-[(triethylsilyl)oxy]pentyl}-octahydro-1H-inden-1-yl]acetic acid
Other name (1):
(1S,3aβ)-4-(Phenylsulfonyl)-4-[4-methyl-4-(triethylsiloxy)pentyl]-7aα-methylhydrindane-1α-acetic acid
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