Chemical Compound

2-[5-(1-{5-[({[(6R)-2-carboxy-3-({[4-(2-{[(2R)-2-[(1-{2-[3-(2,3-dihydro-1H-1lambda5-indol-1-ylium-1-ylidene)-6-(2,3-dihydro-1H-indol-1-yl)-3H-xanthen-9-yl]benzenesulfonyl}piperidin-4-yl)formamido]-2-[(3-{[(2R,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]carbamoyl}propyl)carbamoyl]ethyl]sulfanyl}acetamido)phenyl]sulfanyl}methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]carbamoyl}methyl)carbamoyl]pentyl}-3,3-dimethyl-5-sulfonato-2,3-dihydro-1H-indol-2-ylidene)penta-1,3-dien-1-yl]-1-ethyl-3,3-dimethyl-3H-indol-1-ium-5-sulfonate

返回搜索 申请报价
2-[5-(1-{5-[({[(6R)-2-carboxy-3-({[4-(2-{[(2R)-2-[(1-{2-[3-(2,3-dihydro-1H-1lambda5-indol-1-ylium-1-ylidene)-6-(2,3-dihydro-1H-indol-1-yl)-3H-xanthen-9-yl]benzenesulfonyl}piperidin-4-yl)formamido]-2-[(3-{[(2R,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]carbamoyl}propyl)carbamoyl]ethyl]sulfanyl}acetamido)phenyl]sulfanyl}methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]carbamoyl}methyl)carbamoyl]pentyl}-3,3-dimethyl-5-sulfonato-2,3-dihydro-1H-indol-2-ylidene)penta-1,3-dien-1-yl]-1-ethyl-3,3-dimethyl-3H-indol-1-ium-5-sulfonate 结构式
Primary record

2-[5-(1-{5-[({[(6R)-2-carboxy-3-({[4-(2-{[(2R)-2-[(1-{2-[3-(2,3-dihydro-1H-1lambda5-indol-1-ylium-1-ylidene)-6-(2,3-dihydro-1H-indol-1-yl)-3H-xanthen-9-yl]benzenesulfonyl}piperidin-4-yl)formamido]-2-[(3-{[(2R,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]carbamoyl}propyl)carbamoyl]ethyl]sulfanyl}acetamido)phenyl]sulfanyl}methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]carbamoyl}methyl)carbamoyl]pentyl}-3,3-dimethyl-5-sulfonato-2,3-dihydro-1H-indol-2-ylidene)penta-1,3-dien-1-yl]-1-ethyl-3,3-dimethyl-3H-indol-1-ium-5-sulfonate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177462884
SMILES
CC[N+]1=C(C(C2=C1C=CC(=C2)S(=O)(=O)[O-])(C)C)/C=C/C=C/C=C/3\C(C4=C(N3CCCCCC(=O)NCC(=O)NC5[C@@H]6N(C5=O)C(=C(CS6)CSC7=CC=C(C=C7)NC(=O)CSC[C@@H](C(=O)NCCCC(=O)N[C@@H]8[C@H]([C@@H]([C@H](O[C@H]8O)CO)O)O)NC(=O)C9CCN(CC9)S(=O)(=O)C1=CC=CC=C1C1=C2C=CC(=[N+]3CCC5=CC=CC=C53)C=C2OC2=C1C=CC(=C2)N1CCC2=CC=CC=C21)C(=O)O)C=CC(=C4)S(=O)(=O)[O-])(C)C
Canonical SMILES
CC[N+]1=C(/C=C/C=C/C=C2/N(CCCCCC(=O)NCC(=O)NC3C(=O)N4C(C(=O)O)=C(CSc5ccc(NC(=O)CSC[C@H](NC(=O)C6CCN(S(=O)(=O)c7ccccc7-c7c8ccc(=[N+]9CCc%10ccccc%109)cc-8oc8cc(N9CCc%10ccccc%109)ccc78)CC6)C(=O)NCCCC(=O)N[C@@H]6[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]6O)cc5)CS[C@H]34)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)[O-])ccc21

名称与同义词

  • J2.172.486F
  • 2-[4-[S-[4-[4-Carboxy-7-[N-[6-[2-[5-[(1-ethyl-3,3-dimethyl-5-sulfonato-3H-indole-1-ium)-2-yl]-2,4-pentadienylidene]-3,3-dimethyl-5-sulfonatoindoline-1-yl]hexanoyl]glycylamino]cepham-3-ene-3-ylmethylthio]phenylcarbamoylmethyl]-N-[1-[2-[3-(1-azoniaindan-1-ylidene)-6-(indoline-1-yl)-3H-xanthene-9-yl]phenylsulfonyl]-4-piperidinylcarbonyl]cysteinylamino]butyrylamino]-2-deoxy-beta-D-glucopyranose
  • 2-[5-(1-{5-[({[(6R)-2-carboxy-3-({[4-(2-{[(2R)-2-[(1-{2-[3-(2,3-dihydro-1H-1lambda5-indol-1-ylium-1-ylidene)-6-(2,3-dihydro-1H-indol-1-yl)-3H-xanthen-9-yl]benzenesulfonyl}piperidin-4-yl)formamido]-2-[(3-{[(2R,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]carbamoyl}propyl)carbamoyl]ethyl]sulfanyl}acetamido)phenyl]sulfanyl}methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]carbamoyl}methyl)carbamoyl]pentyl}-3,3-dimethyl-5-sulfonato-2,3-dihydro-1H-indol-2-ylidene)penta-1,3-dien-1-yl]-1-ethyl-3,3-dimethyl-3H-indol-1-ium-5-sulfonate