| SpectraBase Compound ID | 9nJOlnduWEU |
|---|---|
| InChI | InChI=1S/C43H74N2O14/c1-24-21-29(19-20-46)39(59-42-37(49)36(45(9)10)38(27(4)56-42)58-35-23-43(6,51)41(50)28(5)55-35)40(52-11)31(47)22-33(48)53-25(2)15-13-12-14-16-32(24)57-34-18-17-30(44(7)8)26(3)54-34/h12-14,16,20,24-32,34-42,47,49-51H,15,17-19,21-23H2,1-11H3/b13-12+,16-14+/t24-,25-,26-,27-,28+,29+,30+,31-,32+,34-,35+,36-,37-,38-,39+,40+,41+,42+,43-/m1/s1 |
| InChIKey | ACTOXUHEUCPTEW-BWHGAVFKSA-N |
| Mol Weight | 843.1 g/mol |
| Molecular Formula | C43H74N2O14 |
| Exact Mass | 842.514005 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7cFnAxs6wSs |
|---|---|
| Name | Spiramycin |
| Comments | (unverified) |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved. |
| Formula | C43H73N2O15R |
| InChI | InChI=1S/C43H74N2O14/c1-24-21-29(19-20-46)39(59-42-37(49)36(45(9)10)38(27(4)56-42)58-35-23-43(6,51)41(50)28(5)55-35)40(52-11)31(47)22-33(48)53-25(2)15-13-12-14-16-32(24)57-34-18-17-30(44(7)8)26(3)54-34/h12-14,16,20,24-32,34-42,47,49-51H,15,17-19,21-23H2,1-11H3/b13-12+,16-14+/t24-,25-,26-,27-,28+,29+,30+,31-,32+,34-,35+,36-,37-,38-,39+,40+,41+,42+,43-/m1/s1 |
| InChIKey | ACTOXUHEUCPTEW-BWHGAVFKSA-N |
| SMILES | O[C@@]1(CC(O[C@@](C\C=C\C=C\[C@@]([C@@](C[C@@]([C@](O[C@]2([C@@]([C@]([C@](O[C@]3(C[C@@]([C@]([C@@](O3)(C)[H])(O)[H])(C)O)[H])([C@](O2)(C)[H])[H])(N(C)C)[H])(O)[H])[H])([C@]1(OC)[H])[H])(CC=O)[H])(C)[H])(O[C@@]1(CC[C@@]([C@](O1)(C)[H])(N(C)C)[H])[H])[H])(C)[H])=O)[H] |
| SPLASH | splash10-0077-9300000000-826c16b4bd6ea0250676 |
| Source of Spectrum | Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences |