Account XIAP BIR2/BIR2-3 inhibitor-2
- Catalog No. :
- ACCUGF242
- CAS No. :
- 1609384-83-9
- Molecular Formula :
- C80H96N20O12
- Molecular Weight :
- 1529.78
IUPAC Name:(12S,13R,24Z,132S,133R,144Z,7S,10S,19S,22S)-11,131-bis((S)-3,3-dimethyl-2-((S)-2-(methylamino)propanamido)butanoyl)-10,22-bis(naphthalen-2-ylmethyl)-9,12,21,24-tetraoxo-19-(1H-tetrazol-5-yl)-21H,141H-4,16-dioxa-8,11,20,23-tetraaza-2,14(1,4)-ditriazola-1(3,2),13(2,3)-dipyrrolidina-5,17(1,4)-dibenzenacyclotetracosaphane-7-carboxylic acid
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Product Information
| Product Name | XIAP BIR2/BIR2-3 inhibitor-2 |
|---|---|
| IUPAC Name | (12S,13R,24Z,132S,133R,144Z,7S,10S,19S,22S)-11,131-bis((S)-3,3-dimethyl-2-((S)-2-(methylamino)propanamido)butanoyl)-10,22-bis(naphthalen-2-ylmethyl)-9,12,21,24-tetraoxo-19-(1H-tetrazol-5-yl)-21H,141H-4,16-dioxa-8,11,20,23-tetraaza-2,14(1,4)-ditriazola-1(3,2),13(2,3)-dipyrrolidina-5,17(1,4)-dibenzenacyclotetracosaphane-7-carboxylic acid |
| Molecular Formula | C80H96N20O12 |
| Molecular Weight | 1529.78 |
| SMILES | CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](CC1=CC3=C(C=CC=C3)C=C1)C(=O)N[C@H](C(=O)O)CC1=CC=C(C=C1)OCC1=CN(N=N1)[C@@H]1CCN(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)[C@@H]1C(=O)N[C@@H](CC1=CC3=C(C=CC=C3)C=C1)C(=O)N[C@H](C1=NN=NN1)CC1=CC=C(C=C1)OCC1=CN2N=N1)C(C)(C)C |
| InChI Key | CNGSREOQTGGBIC-YZMHPAFASA-N |
| Synonym | XIAP BIR2/BIR2-3 inhibitor-2 |
| CAS No. | 1609384-83-9 |
Synthetic Route by SureRoute
2. ACCUGF242 Molecular Building Block Synthetic Route
XIAP BIR2/BIR2-3 inhibitor-3
((4-((1-((3S,5S)-5-((6-aminohexyl)carbamoyl)-1-(dibenzylglycyl)pyrrolidin-3-yl)-1H-1,2,3-triazol-4-yl)methoxy)phenyl)(benzylamino)methyl)phosphonic acid
N2-(4-(((2-Amino-4-oxo-4,8-dihydropteridin-6-yl)methyl)amino)benzoyl)-N5-((1-(5-(((3R,5S)-1-((S)-2-(2-(3-(2-(2-((S)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl)acetamido)ethoxy)propoxy)acetamido)-3,3-dimethylbutanoyl)-5-(((S)-1-(4-(4-methylthiazol-5-yl)phenyl)ethyl)carbamoyl)pyrrolidin-3-yl)oxy)-5-oxopentyl)-1H-1,2,3-triazol-4-yl)methyl)-L-glutamine