1-Carba-1-deazariboflavin
7,8-dimethyl-5-(2,3,4,5-tetrahydroxypentyl)pyrido[4,3-b]quinoxaline-1,3-dione
Also Known As: 1-Deazariboflavin|1-deaza RF|1-Carba-1-deazariboflavin|7,8-dimethyl-5-(2,3,4,5-tetrahydroxypentyl)pyrido[4,3-b]quinoxaline-1,3-dione|1-deoxy-1-(7,8-dimethyl-1,3-dioxo-2,3-dihydropyrido[3,4-b]quinoxalin-5(1h)-yl)pentitol|1-Deoxy-1-(3-hydroxy-7,8-dimethyl-1-oxopyrido[3,4-b]quinoxalin-5(1H)-yl)pentitol
CAS: 64183-66-0
| Molecular Formula | C18H21N3O6 |
|---|---|
| Molecular Weight | 375.14304 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.14304 |
| Monoisotopic Mass | 375.14304 |
| Heavy Atoms | 27 |
| Complexity | 678.0 |
Chemical Identifiers
| CAS Number | 64183-66-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C3=CC(=O)NC(=O)C3=N2)CC(C(C(CO)O)O)O |
| InChIKey | VVSMAKSRHMDDGV-UHFFFAOYSA-N |
Product Overview
1-Carba-1-deazariboflavin (CAS 64183-66-0), with molecular formula C18H21N3O6 and molecular weight 375.14304 g/mol. IUPAC: 7,8-dimethyl-5-(2,3,4,5-tetrahydroxypentyl)pyrido[4,3-b]quinoxaline-1,3-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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