Chemical Compound

(alphaR,4abeta,10Z)-3beta,5alpha,12alpha-Triacetoxy-4alpha-(chloromethyl)-4,6alpha,7beta-trihydroxy-8beta-chloro-9-methylene-alpha,12aalpha-dimethyl-3,4,4a,5,6,7,8,9,12,12a-decahydrobenzocyclodecene-6-acetic acid 6,7-lactone

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(alphaR,4abeta,10Z)-3beta,5alpha,12alpha-Triacetoxy-4alpha-(chloromethyl)-4,6alpha,7beta-trihydroxy-8beta-chloro-9-methylene-alpha,12aalpha-dimethyl-3,4,4a,5,6,7,8,9,12,12a-decahydrobenzocyclodecene-6-acetic acid 6,7-lactone 结构式
Primary record

(alphaR,4abeta,10Z)-3beta,5alpha,12alpha-Triacetoxy-4alpha-(chloromethyl)-4,6alpha,7beta-trihydroxy-8beta-chloro-9-methylene-alpha,12aalpha-dimethyl-3,4,4a,5,6,7,8,9,12,12a-decahydrobenzocyclodecene-6-acetic acid 6,7-lactone

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177404794
SMILES
CC1C(=O)O[C@@H]2[C@]1([C@H]([C@@H]3[C@](C=C[C@H]([C@@]3(CCl)O)OC(=O)C)([C@H](/C=C\C(=C)[C@@H]2Cl)OC(=O)C)C)OC(=O)C)O
Canonical SMILES
C=C1/C=C\[C@H](OC(C)=O)[C@@]2(C)C=C[C@@H](OC(C)=O)[C@](O)(CCl)[C@@H]2[C@H](OC(C)=O)[C@@]2(O)C(C)C(=O)O[C@H]2[C@H]1Cl

名称与同义词

  • Robustolide D
  • J2.533.456F
  • (1S,2S,3S,4R,7R,8S,10Z,12S,13S,16R,17S)-2,16-bis(acetyloxy)-8-chloro-17-(chloromethyl)-3,17-dihydroxy-4,13-dimethyl-9-methylidene-5-oxo-6-oxatricyclo[11.4.0.03,7]heptadeca-10,14-dien-12-yl acetate
  • (alphaR,4abeta,10Z)-3beta,5alpha,12alpha-Triacetoxy-4alpha-(chloromethyl)-4,6alpha,7beta-trihydroxy-8beta-chloro-9-methylene-alpha,12aalpha-dimethyl-3,4,4a,5,6,7,8,9,12,12a-decahydrobenzocyclodecene-6-acetic acid 6,7-lactone