Triamcinolone aminobenzal benzamidoisobutyrate
[2-[(1S,2S,8S,9S,13S)-6-[4-(dimethylamino)phenyl]-12-fluoro-11-hydroxy-9,13-dimethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] 3-benzamido-2-methylpropanoate
Also Known As: TBI-PAB|Taucorten|Triamcinolone aminobenzal benzamidoisobutyrate|16-alpha,17-alpha-(p-Dimethylaminobenzyliden)triamcinolone 21-(beta-benzoylamino)isobutyrate|Pregna-1,4-diene-3,20-dione, 21-(3-(benzoylamino)-2-methyl-1-oxopropoxy)-16,17-(((4-(dimethylamino)phenyl)methylene)bis(oxy))-9-fluoro-11-hydroxy-|tetra-P-phenyl-P,P'-ethane-1,2-diyl-bis-phosphane P-oxide P'-sulfide|2-{(4aS,6aS,6bS,10aS,10bS)-8-[4-(Dimethylamino)phenyl]-4b-fluoro-5-hydroxy-4a,6a-dimethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bH,8H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl}-2-oxoethyl 3-benzamido-2-methylpropanoate
| Molecular Formula | C41H47FN2O8 |
|---|---|
| Molecular Weight | 714.33167 g/mol |
| LogP | 5.0645 |
| Topological Polar Surface Area | 131.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 714.33167 |
| Monoisotopic Mass | 714.33167 |
| Heavy Atoms | 52 |
| Complexity | 1828.9882 |
Chemical Identifiers
| CAS Number | 51241-99-7 |
|---|---|
| SMILES | CC(CNC(=O)C1=CC=CC=C1)C(=O)OCC(=O)[C@@]23C(C[C@@H]4[C@@]2(CC(C5([C@H]4CCC6=CC(=O)C=C[C@@]65C)F)O)C)OC(O3)C7=CC=C(C=C7)N(C)C |
Product Overview
Triamcinolone aminobenzal benzamidoisobutyrate (CAS 51241-99-7), with molecular formula C41H47FN2O8 and molecular weight 714.33167 g/mol. IUPAC: [2-[(1S,2S,8S,9S,13S)-6-[4-(dimethylamino)phenyl]-12-fluoro-11-hydroxy-9,13-dimethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] 3-benzamido-2-methylpropanoate.
Triamcinolone aminobenzal benzamidoisobutyrate is a custom synthesis product. We offer services from milligram to kilogram scale.
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