Candicidin D, 40-demethyl-3,7-dideoxo-3,7-dihydroxy-N47-methyl-5-oxo-, cyclic 15,19-hemiacetal
Modify Date: 2025-08-26 09:45:32
Candicidin D, 40-demethyl-3,7-dideoxo-3,7-dihydroxy-N47-methyl-5-oxo-, cyclic 15,19-hemiacetal structure
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Common Name | Candicidin D, 40-demethyl-3,7-dideoxo-3,7-dihydroxy-N47-methyl-5-oxo-, cyclic 15,19-hemiacetal | ||
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| CAS Number | 76551-64-9 | Molecular Weight | 1127.316 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 1285.3±65.0 °C at 760 mmHg | |
| Molecular Formula | C59H86N2O19 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 731.1±34.3 °C | |
| Name | 33-[(3-Amino-3,6-dideoxy-β-D-mannopyranosyl)oxy]-1,3,5,7,9,13,37-heptahydroxy-17-{5-hydroxy-7-[4-(methylamino)phenyl]-7-oxo-2-heptanyl}-18-methyl-11,15-dioxo-16,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylic acid |
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| Synonym | More Synonyms |
| Density | 1.3±0.1 g/cm3 |
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| Boiling Point | 1285.3±65.0 °C at 760 mmHg |
| Molecular Formula | C59H86N2O19 |
| Molecular Weight | 1127.316 |
| Flash Point | 731.1±34.3 °C |
| Exact Mass | 1126.582520 |
| LogP | 0.98 |
| Vapour Pressure | 0.0±0.3 mmHg at 25°C |
| Index of Refraction | 1.622 |
| InChIKey | PILBMRSRDPAALN-OUXUIHJTSA-N |
| SMILES | CNc1ccc(C(=O)CC(O)CCC(C)C2OC(=O)CC(O)CC(=O)CC(O)CC(O)CC(O)CC(O)CC3(O)CC(O)C(C(=O)O)C(CC(OC4OC(C)C(O)C(N)C4O)C=CC=CC=CC=CC=CC=CC=CC2C)O3)cc1 |
| 16,39-Dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylic acid, 33-[(3-amino-3,6-dideoxy-β-D-mannopyranosyl)oxy]-1,3,5,7,9,13,37-heptahydroxy-17-[4-hydroxy-1-methyl-6-[4-( methylamino)phenyl]-6-oxohexyl]-18-methyl-11,15-dioxo- |
| 33-[(3-Amino-3,6-dideoxy-β-D-mannopyranosyl)oxy]-1,3,5,7,9,13,37-heptahydroxy-17-{5-hydroxy-7-[4-(methylamino)phenyl]-7-oxo-2-heptanyl}-18-methyl-11,15-dioxo-16,39-dioxabicyclo[33.3.1]nonatriaconta -19,21,23,25,27,29,31-heptaene-36-carboxylic acid |
| EINECS 278-489-7 |