Chem
J-GLOBAL ID：200907099636179481   Nikkaji number：J2.311.288D

(9R)-5,12β,16α,18,20β,22α-Hexamethyl-4,6-dimethoxy-7-(tert-butyldimethylsiloxy)-9α,13α-epoxy-3,8-cyclocyclodocosa-3,5,7,17-tetraene-1-yne-11-one

(9R)-5,12β,16α,18,20β,22α-ヘキサメチル-4,6-ジメトキシ-7-(tert-ブチルジメチルシロキシ)-9α,13α-エポキシ-3,8-シクロシクロドコサ-3,5,7,17-テトラエン-1-イン-11-オン
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： C36H56O5Si
Molecular formula furigana： C36-H56-O5-SI
Molecular weight： 596.924
InChI： InChI=1S/C36H56O5Si/c1-22-14-16-28-32(35(41-42(12,13)36(7,8)9)34(39-11)27(6)33(28)38-10)31-21-29(37)26(5)30(40-31)17-15-23(2)19-25(4)20-24(3)18-22/h19,22-24,26,30-31H,15,17-18,20-21H2,1-13H3/t22-,23+,24+,26-,30-,31-/m1/s1
InChI key： OTLDVVCIEMRSKU-VHKSBVIWSA-N
SMILES： COc1c(C)c(OC)c2C#C[C@@H](C)C[C@H](C)CC(=C[C@@H](C)CC[C@H]3O[C@H](CC(=O)[C@H]3C)c2c1O[Si](C)(C)C(C)(C)C)C
Systematic name  (3)：
  • (9R)-5,12β,16α,18,20β,22α-ヘキサメチル-4,6-ジメトキシ-7-(tert-ブチルジメチルシロキシ)-9α,13α-エポキシ-3,8-シクロシクロドコサ-3,5,7,17-テトラエン-1-イン-11-オン
  • (1R,10S,12S,16S,19R,20S)-3-[(tert-ブチルジメチルシリル)オキシ]-4,6-ジメトキシ-5,10,12,14,16,20-ヘキサメチル-23-オキサトリシクロ[17.3.1.02,7]トリコサ-2,4,6,14-テトラエン-8-イン-21-オン
  • (1R,10S,12S,16S,19R,20S)-3-[(tert-butyldimethylsilyl)oxy]-4,6-dimethoxy-5,10,12,14,16,20-hexamethyl-23-oxatricyclo[17.3.1.02,7]tricosa-2,4,6,14-tetraen-8-yn-21-one
Other name (1)：
  • (9R)-5,12β,16α,18,20β,22α-Hexamethyl-4,6-dimethoxy-7-(tert-butyldimethylsiloxy)-9α,13α-epoxy-3,8-cyclocyclodocosa-3,5,7,17-tetraene-1-yne-11-one
Thsaurus map：
Thesaurus Map

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