Chemical Compound

4- {[(1R,2R,5R,10S,13R,14R, 17S,19R)-5-[2- (benzylamino)ethyl]- 1,2,14,18,18- pentamethyl-7-oxo-8- (propan-2- yl)pentacyclo[11.8.0.0{circumflex over ()} {2,10}.0{circumflex over ()}{5,9}.0{circumflex over ()}{14,19}] henicos-8-en-17-yl]oxy}- 2,2-dimethyl-4- oxobutanoic acid

4- {[(1R,2R,5R,10S,13R,14R, 17S,19R)-5-[2- (benzylamino)ethyl]- 1,2,14,18,18- pentamethyl-7-oxo-8- (propan-2- yl)pentacyclo[11.8.0.0{circumflex over ()} {2,10}.0{circumflex over ()}{5,9}.0{circumflex over ()}{14,19}] henicos-8-en-17-yl]oxy}- 2,2-dimethyl-4- oxobutanoic acid 结构式
Primary record

4- {[(1R,2R,5R,10S,13R,14R, 17S,19R)-5-[2- (benzylamino)ethyl]- 1,2,14,18,18- pentamethyl-7-oxo-8- (propan-2- yl)pentacyclo[11.8.0.0{circumflex over ()} {2,10}.0{circumflex over ()}{5,9}.0{circumflex over ()}{14,19}] henicos-8-en-17-yl]oxy}- 2,2-dimethyl-4- oxobutanoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
71614133
SMILES
CC(C)C1=C2[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC[C@]2(CC1=O)CCNCC6=CC=CC=C6)C)C)(C)C)OC(=O)CC(C)(C)C(=O)O)C
Canonical SMILES
CC(C)C1=C2[C@H]3CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)CC(C)(C)C(=O)O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(CCNCc2ccccc2)CC1=O

名称与同义词

  • CHEMBL5830814
  • SCHEMBL15039285
  • US10064873, Example 6
  • BDBM271389
  • 4- {[(1R,2R,5R,10S,13R,14R, 17S,19R)-5-[2- (benzylamino)ethyl]- 1,2,14,18,18- pentamethyl-7-oxo-8- (propan-2- yl)pentacyclo[11.8.0.0{circumflex over ()} {2,10}.0{circumflex over ()}{5,9}.0{circumflex over ()}{14,19}] henicos-8-en-17-yl]oxy}- 2,2-dimethyl-4- oxobutanoic acid