Chem
J-GLOBAL ID：200907074810983101   Nikkaji number：J1.569.983C

(3S,6R,7S,8S,12E,15S,16E)-3,7,15-Tris(tert-butyldimethylsiloxy)-4,4,6,8,12,16-hexamethyl-5-oxo-17-(2-methyl-5-thiazolyl)-12,16-heptadecadiene-9-ynoic acid methyl ester

(3S,6R,7S,8S,12E,15S,16E)-3,7,15-トリス(tert-ブチルジメチルシロキシ)-4,4,6,8,12,16-ヘキサメチル-5-オキソ-17-(2-メチル-5-チアゾリル)-12,16-ヘプタデカジエン-9-イン酸メチル
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： C46H83NO6SSi3
Molecular formula furigana： C46-H83-N-O6-S-SI3
Molecular weight： 862.490
InChI： InChI=1S/C46H83NO6SSi3/c1-32(27-28-38(51-55(18,19)43(6,7)8)34(3)29-37-31-47-36(5)54-37)25-24-26-33(2)41(53-57(22,23)45(12,13)14)35(4)42(49)46(15,16)39(30-40(48)50-17)52-56(20,21)44(9,10)11/h27,29,31,33,35,38-39,41H,25,28,30H2,1-23H3/b32-27+,34-29+/t33-,35+,38-,39-,41-/m0/s1
InChI key： QHGDKVHUTGJUHN-WKEBGYCBSA-N
SMILES： COC(=O)C[C@H](O[Si](C)(C)C(C)(C)C)C(C)(C)C(=O)[C@H](C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](C)C#CC/C(=C/C[C@H](O[Si](C)(C)C(C)(C)C)/C(=C/c1cnc(C)s1)/C)/C
Systematic name  (3)：
  • (3S,6R,7S,8S,12E,15S,16E)-3,7,15-トリス(tert-ブチルジメチルシロキシ)-4,4,6,8,12,16-ヘキサメチル-5-オキソ-17-(2-メチル-5-チアゾリル)-12,16-ヘプタデカジエン-9-イン酸メチル
  • メチル (3S,6R,7S,8S,12E,15S,16E)-3,7,15-トリス[(tert-ブチルジメチルシリル)オキシ]-4,4,6,8,12,16-ヘキサメチル-17-(2-メチル-1,3-チアゾール-5-イル)-5-オキソヘプタデカ-12,16-ジエン-9-イノアート
  • methyl (3S,6R,7S,8S,12E,15S,16E)-3,7,15-tris[(tert-butyldimethylsilyl)oxy]-4,4,6,8,12,16-hexamethyl-17-(2-methyl-1,3-thiazol-5-yl)-5-oxoheptadeca-12,16-dien-9-ynoate
Other name (1)：
  • (3S,6R,7S,8S,12E,15S,16E)-3,7,15-Tris(tert-butyldimethylsiloxy)-4,4,6,8,12,16-hexamethyl-5-oxo-17-(2-methyl-5-thiazolyl)-12,16-heptadecadiene-9-ynoic acid methyl ester
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