SpectraBase Compound ID | LPGGtXaf4Lt |
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InChI | InChI=1S/C28H38N2O4.2ClH.7H2O/c1-5-17-16-30-9-7-19-13-27(33-3)28(34-4)15-22(19)24(30)11-20(17)10-23-21-14-26(32-2)25(31)12-18(21)6-8-29-23;;;;;;;;;/h12-15,17,20,23-24,29,31H,5-11,16H2,1-4H3;2*1H;7*1H2/t17-,20-,23+,24-;;;;;;;;;/m0........./s1 |
InChIKey | DFAXGZYTCIFHEW-PUJYRUHLSA-N |
Mol Weight | 665.649 g/mol |
Molecular Formula | C28H54Cl2N2O11 |
Exact Mass | 664.310466 g/mol |
SpectraBase Spectrum ID | 1HPA3s4HopA |
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Name | cephaeline, dihydrochloride, heptahydrate |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C28H54Cl2N2O11 |
InChI | InChI=1S/C28H38N2O4.2ClH.7H2O/c1-5-17-16-30-9-7-19-13-27(33-3)28(34-4)15-22(19)24(30)11-20(17)10-23-21-14-26(32-2)25(31)12-18(21)6-8-29-23;;;;;;;;;/h12-15,17,20,23-24,29,31H,5-11,16H2,1-4H3;2*1H;7*1H2/t17-,20-,23+,24-;;;;;;;;;/m0........./s1 |
InChIKey | DFAXGZYTCIFHEW-PUJYRUHLSA-N |
Sadtler IR Number | 1396 |
Sadtler UV Number | 11427N |
Solvent | Methanol |