Chemical Compound

3-{[(2S)-2-[5-({6,6'-bis[(1S)-2-(3-carboxy-2,3-dihydroxy-N-methylpropanamido)-1-hydroxyethyl]-5'-({6-[(1S)-2-(3-carboxy-2,3-dihydroxy-N-methylpropanamido)-1-hydroxyethyl]-4-hydroxy-3-oxocyclohexa-1,4-dien-1-yl}oxy)-3,3'-dioxo-[1,1'-bi(cyclohexane)]-1,1',4,4'-tetraen-4-yl}peroxy)-2-iodo-4-oxocyclohexa-2,5-dien-1-yl]-2-hydroxyethyl](methyl)carbamoyl}-2,3-dihydroxypropanoic acid

3-{[(2S)-2-[5-({6,6'-bis[(1S)-2-(3-carboxy-2,3-dihydroxy-N-methylpropanamido)-1-hydroxyethyl]-5'-({6-[(1S)-2-(3-carboxy-2,3-dihydroxy-N-methylpropanamido)-1-hydroxyethyl]-4-hydroxy-3-oxocyclohexa-1,4-dien-1-yl}oxy)-3,3'-dioxo-[1,1'-bi(cyclohexane)]-1,1',4,4'-tetraen-4-yl}peroxy)-2-iodo-4-oxocyclohexa-2,5-dien-1-yl]-2-hydroxyethyl](methyl)carbamoyl}-2,3-dihydroxypropanoic acid 结构式
Primary record

3-{[(2S)-2-[5-({6,6'-bis[(1S)-2-(3-carboxy-2,3-dihydroxy-N-methylpropanamido)-1-hydroxyethyl]-5'-({6-[(1S)-2-(3-carboxy-2,3-dihydroxy-N-methylpropanamido)-1-hydroxyethyl]-4-hydroxy-3-oxocyclohexa-1,4-dien-1-yl}oxy)-3,3'-dioxo-[1,1'-bi(cyclohexane)]-1,1',4,4'-tetraen-4-yl}peroxy)-2-iodo-4-oxocyclohexa-2,5-dien-1-yl]-2-hydroxyethyl](methyl)carbamoyl}-2,3-dihydroxypropanoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
101373775
SMILES
CN(C[C@H](C1C=C(C(=O)C=C1OC2=CC(=O)C=C(C2[C@@H](CN(C)C(=O)C(C(C(=O)O)O)O)O)C3=CC(=O)C(=CC3[C@@H](CN(C)C(=O)C(C(C(=O)O)O)O)O)OOC4=CC(C(=CC4=O)I)[C@@H](CN(C)C(=O)C(C(C(=O)O)O)O)O)O)O)C(=O)C(C(C(=O)O)O)O
Canonical SMILES
CN(C[C@@H](O)C1C=C(OOC2=CC([C@H](O)CN(C)C(=O)C(O)C(O)C(=O)O)C(C3=CC(=O)C=C(OC4=CC(=O)C(O)=CC4[C@H](O)CN(C)C(=O)C(O)C(O)C(=O)O)C3[C@H](O)CN(C)C(=O)C(O)C(O)C(=O)O)=CC2=O)C(=O)C=C1I)C(=O)C(O)C(O)C(=O)O

名称与同义词

  • J2.247.110D
  • 3-{[(2S)-2-[5-({6,6'-bis[(1S)-2-(3-carboxy-2,3-dihydroxy-N-methylpropanamido)-1-hydroxyethyl]-5'-({6-[(1S)-2-(3-carboxy-2,3-dihydroxy-N-methylpropanamido)-1-hydroxyethyl]-4-hydroxy-3-oxocyclohexa-1,4-dien-1-yl}oxy)-3,3'-dioxo-[1,1'-bi(cyclohexane)]-1,1',4,4'-tetraen-4-yl}peroxy)-2-iodo-4-oxocyclohexa-2,5-dien-1-yl]-2-hydroxyethyl](methyl)carbamoyl}-2,3-dihydroxypropanoic acid
  • 5-[6 -Hydroxy[3,3 -oxybis[4-[(S)-1-hydroxy-2-[methyl(2,3-dihydroxy-3-carboxypropionyl)amino]ethyl]-1-oxo-2,5-cyclohexadiene]]-5-yl]-4-[(S)-1-hydroxy-2-[methyl(2,3-dihydroxy-3-carboxypropionyl)amino]ethyl]-1-oxo-2,5-cyclohexadiene-2-yl[4-[(S)-1-hydroxy-2-[methyl(2,3-dihydroxy-3-carboxypropionyl)amino]ethyl]-1-oxo-5-iodo-2,5-cyclohexadiene-2-yl] peroxide