![#1;HEDAMYCIN;2-(3,3'-DIMETHYL-[2,2'-BIOXIRAN]-3-YL)-11-HYDROXY-5-METHYL-8-[2,3,6-TRIDEOXY-3-(DIMETHYLAMINO)-BETA-D-ARABINO-HEXOPYRANOSYL]-10-[2,3-6-TRIDEOXY-3-](/api/spectrum/KeT7eKDChDB/structure.png?h=300&w=458 "#1;HEDAMYCIN;2-(3,3'-DIMETHYL-[2,2'-BIOXIRAN]-3-YL)-11-HYDROXY-5-METHYL-8-[2,3,6-TRIDEOXY-3-(DIMETHYLAMINO)-BETA-D-ARABINO-HEXOPYRANOSYL]-10-[2,3-6-TRIDEOXY-3-")
| SpectraBase Compound ID | 81sV8uVgYne |
|---|---|
| InChI | InChI=1S/C41H50N2O11/c1-16-11-22-30(37-28(16)24(44)14-27(53-37)41(6)39(54-41)36-18(3)52-36)35(48)31-29(34(22)47)20(25-13-23(42(7)8)32(45)17(2)50-25)12-21(33(31)46)26-15-40(5,43(9)10)38(49)19(4)51-26/h11-12,14,17-19,23,25-26,32,36,38-39,45-46,49H,13,15H2,1-10H3/t17-,18+,19+,23-,25-,26-,32-,36+,38-,39+,40+,41+/m0/s1 |
| InChIKey | RZOFHOWMWMTHDX-JUHVKBHKSA-N |
| Mol Weight | 746.9 g/mol |
| Molecular Formula | C41H50N2O11 |
| Exact Mass | 746.34146 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KeT7eKDChDB |
|---|---|
| Name | #1;HEDAMYCIN;2-(3,3'-DIMETHYL-[2,2'-BIOXIRAN]-3-YL)-11-HYDROXY-5-METHYL-8-[2,3,6-TRIDEOXY-3-(DIMETHYLAMINO)-BETA-D-ARABINO-HEXOPYRANOSYL]-10-[2,3-6-TRIDEOXY-3- |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H50N2O11 |
| InChI | InChI=1S/C41H50N2O11/c1-16-11-22-30(37-28(16)24(44)14-27(53-37)41(6)39(54-41)36-18(3)52-36)35(48)31-29(34(22)47)20(25-13-23(42(7)8)32(45)17(2)50-25)12-21(33(31)46)26-15-40(5,43(9)10)38(49)19(4)51-26/h11-12,14,17-19,23,25-26,32,36,38-39,45-46,49H,13,15H2,1-10H3/t17-,18+,19+,23-,25-,26-,32-,36+,38-,39+,40+,41+/m0/s1 |
| InChIKey | RZOFHOWMWMTHDX-JUHVKBHKSA-N |
| Literature Reference Author | A.FREDENHAGEN,U.SEQUIN |
| Literature Reference Citation | HELV.CHIM.ACTA,68,391(1985) |
| Literature Reference DOI | 10.1002/hlca.19850680213 |
| Molecular Weight | 746.855 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP3945 |