| SpectraBase Compound ID | CeCuVpv3Maa |
|---|---|
| InChI | InChI=1S/C32H56N2O12/c1-11-23-32(8,40)26(37)20(6)28(38)33-16(2)13-31(7,43-15-21-14-42-21)27(18(4)24(35)19(5)29(39)45-23)46-30-25(36)22(34(9,10)41)12-17(3)44-30/h16-23,25-27,30,36-37,40H,11-15H2,1-10H3,(H,33,38) |
| InChIKey | VHIMOTFJXFVVLS-UHFFFAOYSA-N |
| Mol Weight | 660.8 g/mol |
| Molecular Formula | C32H56N2O12 |
| Exact Mass | 660.383325 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 80kgnSLvIuB |
|---|---|
| Name | SYN-3-O-DESCLADINOSYL-3-OXO-6-O-(2''-METHYLOXIRANYL)-8A-AZA-8A-HOMOERYTHROMYCIN_A_N-OXIDE |
| Compound Number | 12A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H56N2O12 |
| InChI | InChI=1S/C32H56N2O12/c1-11-23-32(8,40)26(37)20(6)28(38)33-16(2)13-31(7,43-15-21-14-42-21)27(18(4)24(35)19(5)29(39)45-23)46-30-25(36)22(34(9,10)41)12-17(3)44-30/h16-23,25-27,30,36-37,40H,11-15H2,1-10H3,(H,33,38) |
| InChIKey | VHIMOTFJXFVVLS-UHFFFAOYSA-N |
| Literature Reference Author | D.PAVLOVIC,S.MUTAK |
| Literature Reference Citation | J.MED.CHEM.,53,5868(2010) |
| Literature Reference DOI | 10.1021/jm100711p |
| Molecular Weight | 660.803 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ47437 |