Chem
J-GLOBAL ID：200907070974007663   Nikkaji number：J1.724.597J

(1S,3S,7S,10R,11S,12S,16R)-3-[(E)-1-Methyl-2-(2-methyl-4-thiazolyl)ethenyl]-7,11-bis(tert-butyldimethylsilyloxy)-8,8,10,12,16-pentamethyl-4,17-dioxabicyclo[14.1.0]heptadecane-13-ene-5,9-dione

(1S,3S,7S,10R,11S,12S,16R)-3-[(E)-1-メチル-2-(2-メチル-4-チアゾリル)エテニル]-7,11-ビス(tert-ブチルジメチルシリルオキシ)-8,8,10,12,16-ペンタメチル-4,17-ジオキサビシクロ[14.1.0]ヘプタデカン-13-エン-5,9-ジオン
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： C39H67NO6SSi2
Molecular formula furigana： C39-H67-N-O6-S-SI2
Molecular weight： 734.200
InChI： InChI=1S/C39H67NO6SSi2/c1-25-19-18-20-39(13)32(44-39)22-30(26(2)21-29-24-47-28(4)40-29)43-33(41)23-31(45-48(14,15)36(5,6)7)38(11,12)35(42)27(3)34(25)46-49(16,17)37(8,9)10/h18-19,21,24-25,27,30-32,34H,20,22-23H2,1-17H3/b19-18?,26-21+/t25-,27+,30-,31-,32-,34?,39+/m0/s1
InChI key： PQNFQOUVQQZCIW-MEIHBUQYSA-N
SMILES： C[C@H]1C=CC[C@@]2(C)O[C@H]2C[C@H](OC(=O)C[C@H](O[Si](C)(C)C(C)(C)C)C(C)(C)C(=O)[C@H](C)C1O[Si](C)(C)C(C)(C)C)/C(=C/c1csc(C)n1)/C
Systematic name  (3)：
  • (1S,3S,7S,10R,11S,12S,16R)-3-[(E)-1-メチル-2-(2-メチル-4-チアゾリル)エテニル]-7,11-ビス(tert-ブチルジメチルシリルオキシ)-8,8,10,12,16-ペンタメチル-4,17-ジオキサビシクロ[14.1.0]ヘプタデカン-13-エン-5,9-ジオン
  • (1S,3S,7S,10R,11S,12S,16R)-7,11-ビス[(tert-ブチルジメチルシリル)オキシ]-8,8,10,12,16-ペンタメチル-3-[(1E)-1-(2-メチル-1,3-チアゾール-4-イル)プロパ-1-エン-2-イル]-4,17-ジオキサビシクロ[14.1.0]ヘプタデカ-13-エン-5,9-ジオン
  • (1S,3S,7S,10R,11S,12S,16R)-7,11-bis[(tert-butyldimethylsilyl)oxy]-8,8,10,12,16-pentamethyl-3-[(1E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-4,17-dioxabicyclo[14.1.0]heptadec-13-ene-5,9-dione
Other name (1)：
  • (1S,3S,7S,10R,11S,12S,16R)-3-[(E)-1-Methyl-2-(2-methyl-4-thiazolyl)ethenyl]-7,11-bis(tert-butyldimethylsilyloxy)-8,8,10,12,16-pentamethyl-4,17-dioxabicyclo[14.1.0]heptadecane-13-ene-5,9-dione
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