Chemical Compound

(1S,2S,5aS,6aR,7aR,8S,10S,10aS,11aS,11bR)-10-Acetoxy-2-(acetoxymethyl)-8-(3-furyl)tetradecahydro-10a-hydroxy-2,7a,11b-trimethyl-11-methylene-7-(3-methyl-1-oxobutoxy)-4-oxo-4H-cyclopenta[f]oxepino[4,5-b]benzofuran-1-acetic acid methyl ester

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(1S,2S,5aS,6aR,7aR,8S,10S,10aS,11aS,11bR)-10-Acetoxy-2-(acetoxymethyl)-8-(3-furyl)tetradecahydro-10a-hydroxy-2,7a,11b-trimethyl-11-methylene-7-(3-methyl-1-oxobutoxy)-4-oxo-4H-cyclopenta[f]oxepino[4,5-b]benzofuran-1-acetic acid methyl ester 结构式
Primary record

(1S,2S,5aS,6aR,7aR,8S,10S,10aS,11aS,11bR)-10-Acetoxy-2-(acetoxymethyl)-8-(3-furyl)tetradecahydro-10a-hydroxy-2,7a,11b-trimethyl-11-methylene-7-(3-methyl-1-oxobutoxy)-4-oxo-4H-cyclopenta[f]oxepino[4,5-b]benzofuran-1-acetic acid methyl ester

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
102075001
SMILES
CC(C)CC(=O)OC1[C@H]2[C@H](C(=C)[C@@]3([C@@]1([C@@H](C[C@@H]3OC(=O)C)C4=COC=C4)C)O)[C@]5([C@@H](O2)CC(=O)O[C@]([C@H]5CC(=O)OC)(C)COC(=O)C)C
Canonical SMILES
C=C1[C@H]2[C@@H](O[C@H]3CC(=O)O[C@](C)(COC(C)=O)[C@@H](CC(=O)OC)[C@]32C)C(OC(=O)CC(C)C)[C@@]2(C)[C@H](c3ccoc3)C[C@H](OC(C)=O)[C@]12O

名称与同义词

  • Rohituka 6
  • J2.454.731K
  • (1S,2R,3S,4S,8S,10R,12R,13S,15S,16S)-15-(acetyloxy)-4-[(acetyloxy)methyl]-13-(furan-3-yl)-16-hydroxy-3-(2-methoxy-2-oxoethyl)-2,4,12-trimethyl-17-methylidene-6-oxo-5,9-dioxatetracyclo[8.7.0.02,8.012,16]heptadecan-11-yl 3-methylbutanoate
  • (1S,2S,5aS,6aR,7aR,8S,10S,10aS,11aS,11bR)-10-Acetoxy-2-(acetoxymethyl)-8-(3-furyl)tetradecahydro-10a-hydroxy-2,7a,11b-trimethyl-11-methylene-7-(3-methyl-1-oxobutoxy)-4-oxo-4H-cyclopenta[f]oxepino[4,5-b]benzofuran-1-acetic acid methyl ester