Chem
J-GLOBAL ID:200907002603485664   Nikkaji number:J2.311.282E

(9R)-5,12β,16α,18,20β,22α-Hexamethyl-4,6-dimethoxy-7-(tert-butyldimethylsiloxy)-9α,13α-epoxy-3,8-cyclo-10-oxacyclodocosa-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-10-オキサシクロドコサ-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: C35H54O6Si
Molecular formula furigana: C35-H54-O6-SI
Molecular weight: 598.896
InChI: InChI=1S/C35H54O6Si/c1-21-14-16-27-29(32(41-42(12,13)35(7,8)9)31(38-11)26(6)30(27)37-10)34-39-28(25(5)33(36)40-34)17-15-22(2)19-24(4)20-23(3)18-21/h19,21-23,25,28,34H,15,17-18,20H2,1-13H3/t21-,22+,23+,25+,28-,34-/m1/s1
InChI key: XHLOHSQTTLYINH-QKKQLUJMSA-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](OC(=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-10-オキサシクロドコサ-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-22,23-ジオキサトリシクロ[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-22,23-dioxatricyclo[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-cyclo-10-oxacyclodocosa-3,5,7,17-tetraene-1-yne-11-one
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