Primary record
3-[(3S,6S,9S,12S,15S,20aR)-6-(carboxymethyl)-3-{4-[(4-fluorophenyl)formamido]butyl}-15-(hydroxymethyl)-1,4,7,10,13,16-hexaoxo-12-(4-oxobutyl)-icosahydropyrrolo[1,2-a]1,4,7,10,13,16-hexaazacyclooctadecan-9-yl]propanoic acid
- 库存
- 550 克
- 纯度
- 98.1 %
化合物标识与属性
- PubChem CID
- 101907869
- SMILES
- C1C[C@@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2C1)CO)CCCC=O)CCC(=O)O)CC(=O)O)CCCCNC(=O)C3=CC=C(C=C3)F
- Canonical SMILES
- O=CCCC[C@@H]1NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)c2ccc(F)cc2)NC(=O)[C@H]2CCCN2C(=O)[C@H](CO)NC1=O
名称与同义词
- J3.385.030A
- N6-(4-Fluorobenzoyl)cyclo[Lys-Asp-Glu-3-(3-oxopropyl)-Ala-Ser-D-Pro-]
- 3-[(3S,6S,9S,12S,15S,20aR)-6-(carboxymethyl)-3-{4-[(4-fluorophenyl)formamido]butyl}-15-(hydroxymethyl)-1,4,7,10,13,16-hexaoxo-12-(4-oxobutyl)-icosahydropyrrolo[1,2-a]1,4,7,10,13,16-hexaazacyclooctadecan-9-yl]propanoic acid