Account TGFβR-IN-1
- Catalog No. :
- ACPSCS733
- CAS No. :
- 2857845-36-2
- Molecular Formula :
- C84H121ClFN17O23
- Molecular Weight :
- 1791.44
IUPAC Name:(5S,11S,14S,37S,42S)-1-amino-5-((4-(((((2-(4-(3-chloro-4-fluorophenyl)-5-(3-cyanoimidazo[1,2-b]pyridazin-6-yl)-1H-imidazol-1-yl)ethoxy)methyl)carbamoyl)oxy)methyl)phenyl)carbamoyl)-11-(hydroxymethyl)-14-isobutyl-7,10,13,16,25,34,39,44-octaoxo-18,21,27,30-tetraoxa-6,9,12,15,24,33,38,43-octaazahexacontane-37,42,60-tricarboxylic acid
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Product Information
| Product Name | TGFβR-IN-1 |
|---|---|
| IUPAC Name | (5S,11S,14S,37S,42S)-1-amino-5-((4-(((((2-(4-(3-chloro-4-fluorophenyl)-5-(3-cyanoimidazo[1,2-b]pyridazin-6-yl)-1H-imidazol-1-yl)ethoxy)methyl)carbamoyl)oxy)methyl)phenyl)carbamoyl)-11-(hydroxymethyl)-14-isobutyl-7,10,13,16,25,34,39,44-octaoxo-18,21,27,30-tetraoxa-6,9,12,15,24,33,38,43-octaazahexacontane-37,42,60-tricarboxylic acid |
| Molecular Formula | C84H121ClFN17O23 |
| Molecular Weight | 1791.44 |
| SMILES | O=C([C@@H](NC(CC[C@@H](C(O)=O)NC(CCCCCCCCCCCCCCCCC(O)=O)=O)=O)CCC(NCCOCCOCC(NCCOCCOCC(N[C@@H](CC(C)C)C(N[C@@H](CO)C(NCC(N[C@H](C(NC1=CC=C(COC(NCOCCN2C(C3=NN4C(C=C3)=NC=C4C#N)=C(C5=CC=C(F)C(Cl)=C5)N=C2)=O)C=C1)=O)CCCCN)=O)=O)=O)=O)=O)=O)O |
| InChI Key | RRGOOOPOTXFKKZ-UNVBUFFDSA-N |
| Synonym | 18-[[(1S)-4-[[(1S)-4-[2-[2-[2-[2-[2-[2-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-6-amino-1-[4-[2-[4-(3-chloro-4-fluorophenyl)-5-(3-cyanoimidazo[1,2-b]pyridazin-6-yl)imidazol-1-yl]ethoxymethylcarbamoyloxymethyl]anilino]-1-oxohexan-2-yl]amino]-2-oxoethyl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-1-carboxy-4-oxobutyl]amino]-1-carboxy-4-oxobutyl]amino]-18-oxooctadecanoic acid;AR-IN-1 |
| CAS No. | 2857845-36-2 |
Synthetic Route by SureRoute
2. ACPSCS733 Molecular Building Block Synthetic Route
(1R)-1-[Bis(2-methoxyphenyl)phosphino]-2-[(4S)-4,5-dihydro-4-(1-methylethyl)-2-oxazolyl]ferrocene
1,1-Bis((2S,5S)-2,5-dimethylphospholano)ferrocene(cyclooctadiene)rhodium(I)
1,1-Bis((2S,5S)-2,5-di-i-propylphospholano)ferrocene(cyclooctadiene)rhodium(I)
![(R)-N,N-Dimethyl-1-[(Rp)-1′,2-bis(diphenylphosphino)ferrocenyl]ethylamine structure diagram](https://xchemchain-prod-1253699568.cos.ap-guangzhou.myqcloud.com/production/attachments/2026/07/22/roob/74311-56-1.png?X-Amz-Algorithm=AWS4-HMAC-SHA256&X-Amz-Credential=AKIDT0SoARehYSEnT2RxQiomY7TcckkZDlIx%2F20260731%2Fap-guangzhou%2Fs3%2Faws4_request&X-Amz-Date=20260731T112525Z&X-Amz-Expires=86400&X-Amz-SignedHeaders=host&response-content-disposition=attachment%3B%20filename%3D%2274311-56-1.png%22&x-id=GetObject&X-Amz-Signature=6da3322df47b993e24cd5401c68ce4427950d65de4fbe1518eb5808ac93a9bf2)