Account CCK2R Ligand-Linker Conjugates 1
- Catalog No. :
- ACJJLI934
- CAS No. :
- 1452145-13-9
- Molecular Formula :
- C72H110N12O27S
- Molecular Weight :
- 1607.80
IUPAC Name:(2R,5S,8S,11S,14S)-8-(2-carboxyethyl)-14-(8-(3-(3-((R)-5-cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b][1,4]diazepin-3-yl)ureido)benzamido)octanamido)-2-(mercaptomethyl)-4,7,10,13-tetraoxo-5,11-bis(3-oxo-3-(((2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl)amino)propyl)-3,6,9,12-tetraazaheptadecanedioic acid
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Product Information
| Product Name | CCK2R Ligand-Linker Conjugates 1 |
|---|---|
| IUPAC Name | (2R,5S,8S,11S,14S)-8-(2-carboxyethyl)-14-(8-(3-(3-((R)-5-cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b][1,4]diazepin-3-yl)ureido)benzamido)octanamido)-2-(mercaptomethyl)-4,7,10,13-tetraoxo-5,11-bis(3-oxo-3-(((2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl)amino)propyl)-3,6,9,12-tetraazaheptadecanedioic acid |
| Molecular Formula | C72H110N12O27S |
| Molecular Weight | 1607.80 |
| SMILES | CC(C)(C(CN1C2=CC=CC=C2N(C[C@H](C1=O)NC(NC3=CC(C(NCCCCCCCC(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(O)=O)CS)=O)CCC(NC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)=O)=O)CCC(O)=O)=O)CCC(NC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)=O)=O)CCC(O)=O)=O)=O)=CC=C3)=O)C4CCCCC4)=O)C |
| InChI Key | YORFONXNERNMCL-PLPZWYNCSA-N |
| Synonym | CCK2R Ligand-Linker Conjugates 1 |
| CAS No. | 1452145-13-9 |
Synthetic Route by SureRoute
2. ACJJLI934 Molecular Building Block Synthetic Route
(R)-3-(3-(5-Cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b][1,4]diazepin-3-yl)ureido)benzoic acid
2-(6-Oxo-3-(pyrrolidine-1-carbonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl)acetic acid
Tos-Gly-Pro-Arg-ANBA-IPA