flavin N(6)-(N'-2,4-dinitrophenyl-6-aminohexyl)adenine
Modify Date: 2025-11-25 12:13:07
flavin N(6)-(N'-2,4-dinitrophenyl-6-aminohexyl)adenine structure
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Common Name | flavin N(6)-(N'-2,4-dinitrophenyl-6-aminohexyl)adenine | ||
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| CAS Number | 73121-99-0 | Molecular Weight | 1050.815 | |
| Density | 1.9±0.1 g/cm3 | Boiling Point | N/A | |
| Molecular Formula | C39H48N12O19P2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | (2S,3R,4R)-5-(7,8-Dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-2,3,4-trihydroxypentyl (2R,3S,4R,5R)-5-[6-({6-[(2,4-dinitrophenyl)amino]hexyl}amino)-9H-purin-9-yl]-4-hydroxy-2-(hydroxymethyl)tetrahydro-3-furanyl dihydrogen diphosphate |
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| Synonym | More Synonyms |
| Density | 1.9±0.1 g/cm3 |
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| Molecular Formula | C39H48N12O19P2 |
| Molecular Weight | 1050.815 |
| Exact Mass | 1050.263428 |
| LogP | 1.41 |
| Index of Refraction | 1.782 |
| InChIKey | NYKTUWQZGBKDBC-ODTKMWLQSA-N |
| SMILES | Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(CC(O)C(O)C(O)COP(=O)(O)OP(=O)(O)OC3C(CO)OC(n4cnc5c(NCCCCCCNc6ccc([N+](=O)[O-])cc6[N+](=O)[O-])ncnc54)C3O)c2cc1C |
| (2S,3R,4R)-5-(7,8-Dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-2,3,4-trihydroxypentyl (2R,3S,4R,5R)-5-[6-({6-[(2,4-dinitrophenyl)amino]hexyl}amino)-9H-purin-9-yl]-4-hydroxy-2-(hydroxymethyl)tetrahydro-3-furanyl dihydrogen diphosphate |