Chemical Compound

(2R)-2-[(2S)-6-amino-2-[(2R)-2-[(2R)-2-aminopropanamido]propanamido]hexanamido]-4-{[(2S,5R)-5-{[(2R,3R,4R,5S,6R)-3-acetamido-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-({[({[(2Z,6Z,10Z,14Z,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]oxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-6-(hydroxymethyl)oxan-4-yl]oxy}-3,4-dioxohexan-2-yl]carbamoyl}butanoic acid

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(2R)-2-[(2S)-6-amino-2-[(2R)-2-[(2R)-2-aminopropanamido]propanamido]hexanamido]-4-{[(2S,5R)-5-{[(2R,3R,4R,5S,6R)-3-acetamido-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-({[({[(2Z,6Z,10Z,14Z,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]oxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-6-(hydroxymethyl)oxan-4-yl]oxy}-3,4-dioxohexan-2-yl]carbamoyl}butanoic acid 结构式
Primary record

(2R)-2-[(2S)-6-amino-2-[(2R)-2-[(2R)-2-aminopropanamido]propanamido]hexanamido]-4-{[(2S,5R)-5-{[(2R,3R,4R,5S,6R)-3-acetamido-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-({[({[(2Z,6Z,10Z,14Z,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]oxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-6-(hydroxymethyl)oxan-4-yl]oxy}-3,4-dioxohexan-2-yl]carbamoyl}butanoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
101247073
SMILES
C[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](CCC(=O)N[C@@H](C)C(=O)C(=O)[C@@H](C)O[C@@H]1[C@H]([C@H](O[C@@H]([C@H]1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)NC(=O)C)CO)OP(=O)(O)OP(=O)(O)OC/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)NC(=O)C)C(=O)O)N
Canonical SMILES
CC(=O)N[C@H]1[C@H](O[C@H]2[C@H](O[C@H](C)C(=O)C(=O)[C@H](C)NC(=O)CC[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](C)NC(=O)[C@@H](C)N)C(=O)O)[C@@H](NC(C)=O)[C@@H](OP(=O)(O)OP(=O)(O)OC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)O[C@@H]2CO)O[C@H](CO)[C@@H](O)[C@@H]1O

名称与同义词

  • Lipid II analogue
  • J1.907.887F
  • (2R)-2-[(2S)-6-amino-2-[(2R)-2-[(2R)-2-aminopropanamido]propanamido]hexanamido]-4-{[(2S,5R)-5-{[(2R,3R,4R,5S,6R)-3-acetamido-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-({[({[(2Z,6Z,10Z,14Z,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]oxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-6-(hydroxymethyl)oxan-4-yl]oxy}-3,4-dioxohexan-2-yl]carbamoyl}butanoic acid
  • 4-O-(2-Acetylamino-2-deoxy-beta-D-glucopyranosyl)-3-O-[(1R)-2-(D-Ala-D-Ala-L-Lys-D-gammaGlu-L-Ala-)-1-methyl-2-oxoethyl]-2-(acetylamino)-2-deoxy-alpha-D-glucopyranose 1-diphosphoric acid beta-[(2Z,6Z,10Z,14Z,18E,22E)-3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptene-1-yl] ester