ANSAMYCIN: RIFAMYCIN DERIV
[(9Z,19E,21Z)-2,15,17,33-tetrahydroxy-11-methoxy-3,7,12,14,16,18,22,28-octamethyl-6,23-dioxo-8,30,34-trioxa-24-aza-28-azoniapentacyclo[23.7.1.14,7.05,32.026,31]tetratriaconta-1(33),2,4,9,19,21,25,27,31-nonaen-13-yl] acetate
Also Known As: ANSAMYCIN: RIFAMYCIN DERIV|LM097
CAS: 55686-31-2
| Molecular Formula | C40H51N2O12+ |
|---|---|
| Molecular Weight | 751.3442 g/mol |
| LogP | 4.45962 |
| Topological Polar Surface Area | 193.32 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 2 |
| Exact Mass | 751.3442 |
| Monoisotopic Mass | 751.3442 |
| Heavy Atoms | 54 |
| Complexity | 1982.7308 |
Chemical Identifiers
| CAS Number | 55686-31-2 |
|---|---|
| SMILES | CC1/C=C/C=C(\C(=O)NC2=C3C=[N+](COC3=C4C(=C2O)C(=C(C5=C4C(=O)C(O5)(O/C=C\C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)C)/C |
Product Overview
ANSAMYCIN: RIFAMYCIN DERIV (CAS 55686-31-2), with molecular formula C40H51N2O12+ and molecular weight 751.3442 g/mol. IUPAC: [(9Z,19E,21Z)-2,15,17,33-tetrahydroxy-11-methoxy-3,7,12,14,16,18,22,28-octamethyl-6,23-dioxo-8,30,34-trioxa-24-aza-28-azoniapentacyclo[23.7.1.14,7.05,32.026,31]tetratriaconta-1(33),2,4,9,19,21,25,27,31-nonaen-13-yl] acetate.
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.
View MSDS →
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