Chemical Compound

Octanoic acid (1S)-3alpha-[(1Z,3Z,5R,7S,8R,9E)-5,8-dihydroxy-7-(phosphonooxy)-8-(2-aminoethyl)-10-[(2R)-3beta-ethyl-6-oxo-3,6-dihydro-2H-pyran-2alpha-yl]-1,3,9-decatrienyl]cyclohexane-1alpha-yl ester

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Octanoic acid (1S)-3alpha-[(1Z,3Z,5R,7S,8R,9E)-5,8-dihydroxy-7-(phosphonooxy)-8-(2-aminoethyl)-10-[(2R)-3beta-ethyl-6-oxo-3,6-dihydro-2H-pyran-2alpha-yl]-1,3,9-decatrienyl]cyclohexane-1alpha-yl ester 结构式
Primary record

Octanoic acid (1S)-3alpha-[(1Z,3Z,5R,7S,8R,9E)-5,8-dihydroxy-7-(phosphonooxy)-8-(2-aminoethyl)-10-[(2R)-3beta-ethyl-6-oxo-3,6-dihydro-2H-pyran-2alpha-yl]-1,3,9-decatrienyl]cyclohexane-1alpha-yl ester

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
102324996
SMILES
CCCCCCCC(=O)O[C@H]1CCC[C@H](C1)/C=C\C=C/[C@@H](C[C@@H]([C@@](CCN)(/C=C/[C@@H]2[C@H](C=CC(=O)O2)CC)O)OP(=O)(O)O)O
Canonical SMILES
CCCCCCCC(=O)O[C@H]1CCC[C@@H](/C=C\C=C/[C@H](O)C[C@H](OP(=O)(O)O)[C@](O)(/C=C/[C@H]2OC(=O)C=C[C@@H]2CC)CCN)C1

名称与同义词

  • Phoslactomycin I-j
  • J2.490.249H
  • {[(1Z,3R,4S,6R,7Z,9Z)-3-(2-aminoethyl)-1-[(2R,3S)-3-ethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]-3,6-dihydroxy-10-[(1R,3S)-3-(octanoyloxy)cyclohexyl]deca-1,7,9-trien-4-yl]oxy}phosphonic acid
  • Octanoic acid (1S)-3alpha-[(1Z,3Z,5R,7S,8R,9E)-5,8-dihydroxy-7-(phosphonooxy)-8-(2-aminoethyl)-10-[(2R)-3beta-ethyl-6-oxo-3,6-dihydro-2H-pyran-2alpha-yl]-1,3,9-decatrienyl]cyclohexane-1alpha-yl ester