Account Scopafungin
- Catalog No. :
- ACYURS684
- CAS No. :
- 11056-18-1
- Molecular Formula :
- C59H103N3O18
- Molecular Weight :
- 1142.48
IUPAC Name:3-oxo-3-(((10E,12Z,20E)-5,7,9,19,23,25,27,31,33,34,35-undecahydroxy-8,14,18,22,26,30-hexamethyl-15-((E)-4-methyl-12-(3-methylguanidino)dodec-8-en-2-yl)-17-oxo-16,37-dioxabicyclo[31.3.1]heptatriaconta-10,12,20-trien-3-yl)oxy)propanoic acid
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Product Information
| Product Name | Scopafungin |
|---|---|
| IUPAC Name | 3-oxo-3-(((10E,12Z,20E)-5,7,9,19,23,25,27,31,33,34,35-undecahydroxy-8,14,18,22,26,30-hexamethyl-15-((E)-4-methyl-12-(3-methylguanidino)dodec-8-en-2-yl)-17-oxo-16,37-dioxabicyclo[31.3.1]heptatriaconta-10,12,20-trien-3-yl)oxy)propanoic acid |
| Molecular Formula | C59H103N3O18 |
| Molecular Weight | 1142.48 |
| SMILES | CNC(=N)NCCC/C=C/CCCC(C)CC(C)C1OC(=O)C(C)C(O)/C=C/C(C)C(O)CC(O)C(C)C(O)CCC(C)C(O)CC2(O)OC(CC(OC(=O)CC(=O)O)CC(O)CC(O)C(C)C(O)/C=C/C=C\C1C)CC(O)C2O |
| InChI Key | VAYOSPAPALLOIO-GTGIXXMMSA-N |
| Synonym | Scopafungin;Nsc107041;Propanedioic acid, 1-[5,7,9,19,23,25,27,31,33,34,35-undecahydroxy-15-[11-[[imino(methylamino)methyl]amino]-1,3-dimethyl-7-undecen-1-yl]-8,14,18,22,26,30-hexamethyl-17-oxo-16,37-dioxabicyclo[31.3.1]heptatriaconta-10,12,20-trien-3-yl] ester, stereoisomer |
| CAS No. | 11056-18-1 |
Synthetic Route by SureRoute
2. ACYURS684 Molecular Building Block Synthetic Route
(1S,3R,4R,7R,9R,11R,15S,16S,17R,18S,33R,35S,36R,37S)-33-(((2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-17-(((4R,5R,6S)-4,5-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-1,3,4,7,9,11,37-heptahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,25,27,29,31-hexaene-36-carboxylic acid
(1R,3S,5R,6R,9R,11R,15S,16R,17R,18S,19E,21E,23E,25E,27E,29E,31E,33R,35S,36R,37S)-33-(((2R,3S,4S,5S,6R)-4-Amino-3,5-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylic acid
Amphotericin B trihydrate