| SpectraBase Compound ID | Lc3c3wmtyAR |
|---|---|
| InChI | InChI=1S/C37H67NO13/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-/m1/s1 |
| InChIKey | ULGZDMOVFRHVEP-RWJQBGPGSA-N |
| Mol Weight | 733.9 g/mol |
| Molecular Formula | C37H67NO13 |
| Exact Mass | 733.461241 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EVMm5TjebYR |
|---|---|
| Name | Erythromycin |
| Comments | (unverified) |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved. |
| Formula | C37H67NO13 |
| InChI | InChI=1S/C37H67NO13/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-/m1/s1 |
| InChIKey | ULGZDMOVFRHVEP-RWJQBGPGSA-N |
| SMILES | O[C@@]1(C[C@](C([C@@]([C@]([C@@]([C@](OC([C@@]([C@]([C@@]([C@]1(O[C@@]1(O[C@@](C[C@@]([C@]1(O)[H])(N(C)C)[H])(C)[H])[H])[H])(C)[H])(O[C@@]1(O[C@]([C@@]([C@@](C1)(OC)C)(O)[H])(C)[H])[H])[H])(C)[H])=O)(CC)[H])(O)C)(O)[H])(C)[H])=O)(C)[H])C |
| SPLASH | splash10-0avj-8900000000-16795ee9ece1eefb474f |
| Source of Spectrum | Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences |