![ERYSN-A;[9R,12S]-[TBU2SN]2-O-DERIVATE-OF-9-DEOXO-6-DEOXY-9S-HYDROXY-6,9-EPOXY-ERYTHROMYCIN-A](/api/spectrum/4EAtjalyqeN/structure.png?h=300&w=458 "ERYSN-A;[9R,12S]-[TBU2SN]2-O-DERIVATE-OF-9-DEOXO-6-DEOXY-9S-HYDROXY-6,9-EPOXY-ERYTHROMYCIN-A")
| SpectraBase Compound ID | FeIrMRd6EUR |
|---|---|
| InChI | InChI=1S/C37H65NO13.4C4H9.O.2Sn/c1-14-25-36(10,43)29(40)22(6)37(44)18(2)16-35(9,51-37)31(50-33-27(39)24(38(11)12)15-19(3)46-33)20(4)28(21(5)32(42)48-25)49-26-17-34(8,45-13)30(41)23(7)47-26;4*1-4(2)3;;;/h18-31,33,39-41H,14-17H2,1-13H3;4*1-3H3;;;/q-2;;;;;;2*+1/t18?,19?,20?,21?,22?,23?,24?,25?,26?,27?,28?,29?,30?,31?,33?,34?,35?,36?,37-;;;;;;;/m1......./s1 |
| InChIKey | HKJJSMFXRLWPMQ-UPENZUEFSA-N |
| Mol Weight | 1213.8 g/mol |
| Molecular Formula | C53H101NO14Sn2 |
| Exact Mass | 1215.526611 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4EAtjalyqeN |
|---|---|
| Name | ERYSN-A;[9R,12S]-[TBU2SN]2-O-DERIVATE-OF-9-DEOXO-6-DEOXY-9S-HYDROXY-6,9-EPOXY-ERYTHROMYCIN-A |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H101NO14Sn2 |
| InChI | InChI=1S/C37H65NO13.4C4H9.O.2Sn/c1-14-25-36(10,43)29(40)22(6)37(44)18(2)16-35(9,51-37)31(50-33-27(39)24(38(11)12)15-19(3)46-33)20(4)28(21(5)32(42)48-25)49-26-17-34(8,45-13)30(41)23(7)47-26;4*1-4(2)3;;;/h18-31,33,39-41H,14-17H2,1-13H3;4*1-3H3;;;/q-2;;;;;;2*+1/t18?,19?,20?,21?,22?,23?,24?,25?,26?,27?,28?,29?,30?,31?,33?,34?,35?,36?,37-;;;;;;;/m1......./s1 |
| InChIKey | HKJJSMFXRLWPMQ-UPENZUEFSA-N |
| Literature Reference Author | J.C.MARTINS,R.WILLEM,F.A.G.MERCIER,M.GIELEN,M.BIESEMANS |
| Literature Reference Citation | J.AM.CHEM.SOC.,121,3284(1999) |
| Literature Reference DOI | 10.1021/ja982559t |
| Molecular Weight | 1213.763 g/mol |
| Solvent | C6D6 |
| Source File Reference | UWRU10892 |