Chemical Compound

[(E,2S)-6-bromo-1-[(4S,5R,6R)-6-[[(4S,6R)-6-[(E,4S)-4-hydroxy-4-[(1R,4E,6E,9R,12E,15S,17R)-9-hydroxy-5,13,17-trimethyl-11-methylidene-3-oxo-2,16-dioxabicyclo[13.2.1]octadeca-4,6,12-trien-17-yl]-2-methylbut-2-enyl]-2,2,5,5-tetramethyl-1,3-dioxan-4-yl]methyl]-2,2,5-trimethyl-1,3-dioxan-4-yl]-5-methoxy-4-methylidenehex-5-en-2-yl] hexadecanoate

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[(E,2S)-6-bromo-1-[(4S,5R,6R)-6-[[(4S,6R)-6-[(E,4S)-4-hydroxy-4-[(1R,4E,6E,9R,12E,15S,17R)-9-hydroxy-5,13,17-trimethyl-11-methylidene-3-oxo-2,16-dioxabicyclo[13.2.1]octadeca-4,6,12-trien-17-yl]-2-methylbut-2-enyl]-2,2,5,5-tetramethyl-1,3-dioxan-4-yl]methyl]-2,2,5-trimethyl-1,3-dioxan-4-yl]-5-methoxy-4-methylidenehex-5-en-2-yl] hexadecanoate 结构式
Primary record

[(E,2S)-6-bromo-1-[(4S,5R,6R)-6-[[(4S,6R)-6-[(E,4S)-4-hydroxy-4-[(1R,4E,6E,9R,12E,15S,17R)-9-hydroxy-5,13,17-trimethyl-11-methylidene-3-oxo-2,16-dioxabicyclo[13.2.1]octadeca-4,6,12-trien-17-yl]-2-methylbut-2-enyl]-2,2,5,5-tetramethyl-1,3-dioxan-4-yl]methyl]-2,2,5-trimethyl-1,3-dioxan-4-yl]-5-methoxy-4-methylidenehex-5-en-2-yl] hexadecanoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
10953284
SMILES
CCCCCCCCCCCCCCCC(=O)O[C@H](C[C@H]1[C@H]([C@H](OC(O1)(C)C)C[C@H]2C([C@H](OC(O2)(C)C)C/C(=C/[C@@H]([C@@]3([C@H]4C[C@@H](O3)C/C(=C/C(=C)C[C@@H](C/C=C/C(=C/C(=O)O4)/C)O)/C)C)O)/C)(C)C)C)CC(=C)/C(=C\Br)/OC
Canonical SMILES
C=C1/C=C(\C)C[C@H]2C[C@@H](OC(=O)/C=C(C)/C=C/C[C@@H](O)C1)[C@@](C)([C@@H](O)/C=C(\C)C[C@H]1OC(C)(C)O[C@@H](C[C@H]3OC(C)(C)O[C@@H](C[C@H](CC(=C)/C(=C\Br)OC)OC(=O)CCCCCCCCCCCCCCC)[C@H]3C)C1(C)C)O2

名称与同义词

  • Phormidolide
  • RefChem:929149
  • SCHEMBL29885105
  • CHEBI:201174
  • DTXCID701763694
  • DTXSID401334294
  • CID10953284
  • CID 10953284
  • ((1E,5S,7S,8S,9R,11S,13R,15E,17S)-1-bromo-7,9,11,13,17-pentahydroxy-17-((1R,4E,6E,9S,12E,15S,17R)-9-hydroxy-5,13,17-trimethyl-11-methylidene-3-oxo-2,16-dioxabicyclo(13.2.1)octadeca-4,6,12-trien-17-yl)-2-methoxy-8,12,12,15-tetramethyl-3-methylideneheptadeca-1,15-dien-5-yl) hexadecanoate
  • (1E,5S,7S,8S,9R,11S,13R,15E)-1-bromo-7,9,11,13,17-pentahydroxy-17-((1R,4E,6E,9R,12E,15S,17R)-9-hydroxy-5,13,17-trimethyl-11-methylene-3-oxo-2,16-dioxabicyclo(13.2.1)octadeca-4,6,12-trien-17-yl)-2-methoxy-8,12,12,15-tetramethyl-3-methyleneheptadeca-1,15-dien-5-yl palmitate
  • [(E,2S)-6-bromo-1-[(4S,5R,6R)-6-[[(4S,6R)-6-[(E,4S)-4-hydroxy-4-[(1R,4E,6E,9R,12E,15S,17R)-9-hydroxy-5,13,17-trimethyl-11-methylidene-3-oxo-2,16-dioxabicyclo[13.2.1]octadeca-4,6,12-trien-17-yl]-2-methylbut-2-enyl]-2,2,5,5-tetramethyl-1,3-dioxan-4-yl]methyl]-2,2,5-trimethyl-1,3-dioxan-4-yl]-5-methoxy-4-methylidenehex-5-en-2-yl] hexadecanoate