| SpectraBase Compound ID | bTAKavoiCs |
|---|---|
| InChI | InChI=1S/C37H67NO12/c1-14-26-20(4)29(40)21(5)28(39)18(2)16-36(9,44)33(50-35-30(41)25(38(11)12)15-19(3)46-35)22(6)31(23(7)34(43)48-26)49-27-17-37(10,45-13)32(42)24(8)47-27/h18-27,29-33,35,40-42,44H,14-17H2,1-13H3/t18-,19-,20+,21+,22+,23-,24-,25+,26-,27-,29+,30-,31+,32-,33-,35+,36-,37+/m1/s1 |
| InChIKey | IDRYSCOQVVUBIJ-KIGDRPRISA-N |
| Mol Weight | 717.9 g/mol |
| Molecular Formula | C37H67NO12 |
| Exact Mass | 717.466327 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JseqQ9h7b2m |
|---|---|
| Name | EM-B;12-DEOXY-ERYTHROMYCIN-A;ERYTHROMYCIN-B |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H67NO12 |
| InChI | InChI=1S/C37H67NO12/c1-14-26-20(4)29(40)21(5)28(39)18(2)16-36(9,44)33(50-35-30(41)25(38(11)12)15-19(3)46-35)22(6)31(23(7)34(43)48-26)49-27-17-37(10,45-13)32(42)24(8)47-27/h18-27,29-33,35,40-42,44H,14-17H2,1-13H3/t18-,19-,20+,21+,22+,23-,24-,25+,26-,27-,29+,30-,31+,32-,33-,35+,36-,37+/m1/s1 |
| InChIKey | IDRYSCOQVVUBIJ-KIGDRPRISA-N |
| Literature Reference Author | S.MORIMOTO,T.ADACHI,Y.MISAWA,T.NAGATE,Y.WATANABE,S.OMURA |
| Literature Reference Citation | J.ANTIBIOTICS,43,544(1990) |
| Literature Reference DOI | 10.7164/antibiotics.43.544 |
| Molecular Weight | 717.938 g/mol |
| Sample ID | 65875 |
| Solvent | CDCl3 |