Chem
J-GLOBAL ID:200907091231403545
Nikkaji number:J2.157.036B
(1R,4E,6E)-1-(Triethylsilyloxy)-1-[3-[(1S)-1-(tert-butyldimethylsilyloxy)-3-butynyl]phenyl]-11-(tert-butyldimethylsilyloxy)-4,6-dodecadiene-3-one
(1R,4E,6E)-1-(トリエチルシリルオキシ)-1-[3-[(1S)-1-(tert-ブチルジメチルシリルオキシ)-3-ブチニル]フェニル]-11-(tert-ブチルジメチルシリルオキシ)-4,6-ドデカジエン-3-オン
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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:
C40 H70 O4 Si3
Molecular formula furigana:
C40-H70-O4-SI3
Molecular weight:
699.251
InChI:
InChI=1S/C40H70O4Si3/c1-16-26-37(43-46(14,15)40(9,10)11)34-28-25-29-35(31-34)38(44-47(17-2,18-3)19-4)32-36(41)30-24-22-20-21-23-27-33(5)42-45(12,13)39(6,7)8/h1,20,22,24-25,28-31,33,37-38H,17-19,21,23,26-27,32H2,2-15H3/b22-20+,30-24+/t33?,37-,38+/m0/s1
InChI key:
NKGRHIRLOYIZLG-MMLCHZMVSA-N
SMILES:
CC[Si](CC)(CC)O[C@H](CC(=O)/C=C/C=C/CCCC(C)O[Si](C)(C)C(C)(C)C)c1cccc(c1)[C@H](CC#C)O[Si](C)(C)C(C)(C)C
Systematic name (3):
(1R,4E,6E)-1-(トリエチルシリルオキシ)-1-[3-[(1S)-1-(tert-ブチルジメチルシリルオキシ)-3-ブチニル]フェニル]-11-(tert-ブチルジメチルシリルオキシ)-4,6-ドデカジエン-3-オン
(5R,8E,10E)-5-{3-[(1S)-1-[(tert-ブチルジメチルシリル)オキシ]ブタ-3-イン-1-イル]フェニル}-3,3-ジエチル-15,17,17,18,18-ペンタメチル-4,16-ジオキサ-3,17-ジシラノナデカ-8,10-ジエン-7-オン
(5R,8E,10E)-5-{3-[(1S)-1-[(tert-butyldimethylsilyl)oxy]but-3-yn-1-yl]phenyl}-3,3-diethyl-15,17,17,18,18-pentamethyl-4,16-dioxa-3,17-disilanonadeca-8,10-dien-7-one
Other name (1):
(1R,4E,6E)-1-(Triethylsilyloxy)-1-[3-[(1S)-1-(tert-butyldimethylsilyloxy)-3-butynyl]phenyl]-11-(tert-butyldimethylsilyloxy)-4,6-dodecadiene-3-one
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