Account Antibacterial agent 109
- Catalog No. :
- ACYTPS616
- CAS No. :
- 2649396-65-4
- Molecular Formula :
- C50H75N7O8
- Molecular Weight :
- 902.19
IUPAC Name:(4R,5S,6S,7R,9R,11E,13E,15R,16R)-15-(azepan-1-ylmethyl)-6-(((2R,3R,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-16-ethyl-4-hydroxy-5,9,13-trimethyl-7-(2-(methyl((1-(quinolin-3-yl)-1H-1,2,3-triazol-4-yl)methyl)amino)ethyl)oxacyclohexadeca-11,13-diene-2,10-dione
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Product Information
| Product Name | Antibacterial agent 109 |
|---|---|
| IUPAC Name | (4R,5S,6S,7R,9R,11E,13E,15R,16R)-15-(azepan-1-ylmethyl)-6-(((2R,3R,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-16-ethyl-4-hydroxy-5,9,13-trimethyl-7-(2-(methyl((1-(quinolin-3-yl)-1H-1,2,3-triazol-4-yl)methyl)amino)ethyl)oxacyclohexadeca-11,13-diene-2,10-dione |
| Molecular Formula | C50H75N7O8 |
| Molecular Weight | 902.19 |
| SMILES | CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)[C@@H](O)[C@H](N(C)C)[C@H]2O)[C@@H](CCN(C)CC2=CN(C3=CC4=CC=CC=C4N=C3)N=N2)C[C@@H](C)C(=O)/C=C/C(C)=C/[C@@H]1CN1CCCCCC1 |
| InChI Key | IHJKKUFHLWJRNI-HFZQUGABSA-N |
| Synonym | 23-De[(6-deoxy-2,3-di-O-methyl-β-D-allopyranosyl)oxy]-4A-O-de(2,6-dideoxy-3-C-methyl-α-L-ribo-hexopyranosyl)-20-deoxo-23-(hexahydro-1H-azepin-1-yl)-20-[methyl[[1-(3-quinolinyl)-1H-1,2,3-triazol-4-yl]methyl]amino]tylosin |
| CAS No. | 2649396-65-4 |
Synthetic Route by SureRoute
2. ACYTPS616 Molecular Building Block Synthetic Route
ACDNEY033
(2S,3S,4S,5R,6S)-6-(2-(2-(2-((3-(((2S,3R,4R,5S,6R)-2-(3-((1-(3-((2-((5-((5S,8S,11S,12R)-11-((S)-sec-butyl)-12-(2-((S)-2-((1R,2R)-3-(((1S,2R)-1-hydroxy-1-phenylpropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-2-oxoethyl)-5,8-diisopropyl-4,10-dimethyl-3,6,9-trioxo-2,13-dioxa-4,7,10-triazatetradecyl)-2-(((2S,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)phenyl)amino)-2-oxoethyl)amino)-3-oxopropyl)-2,5-dioxopyrrolidin-3-yl)thio)propoxy)-3-(4-(24-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-3,19-dioxo-6,9,12,15-tetraoxa-2,18-diazatetracosyl)-1H-1,2,3-triazol-1-yl)-5-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl)oxy)propyl)thio)acetamido)acetamido)-4-(((((1S,9S)-9-ethyl-5-fluoro-9-hydroxy-4-methyl-10,13-dioxo-2,3,9,10,13,15-hexahydro-1H,12H-benzo[de]pyrano[3',4':6,7]indolizino[1,2-b]quinolin-1-yl)carbamoyl)oxy)methyl)phenoxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
(4R,5S,6S,7R,9R,11E,13E,15R,16R)-6-(((2R,3R,4S,5S,6R)-4-(Dimethylamino)-3,5-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-16-ethyl-4-hydroxy-5,9,13-trimethyl-7-(2-(piperidin-1-yl)ethyl)-15-(piperidin-1-ylmethyl)oxacyclohexadeca-11,13-diene-2,10-dione
