| SpectraBase Compound ID | DyJXnxVm4rn |
|---|---|
| InChI | InChI=1S/C53H87ClN14O17/c1-3-5-6-7-8-9-13-17-31(70)25-40(72)61-39(29-85-41(73)26-32(71)27-54)51(82)67-38(28-69)50(81)65-36(20-22-56)48(79)64-35(19-21-55)47(78)63-34(18-14-23-60-53(58)59)46(77)66-37(24-30-15-11-10-12-16-30)49(80)62-33(4-2)45(76)68-42(44(57)75)43(74)52(83)84/h4,10-12,15-16,31-32,34-39,42-43,69-71,74H,3,5-9,13-14,17-29,55-56H2,1-2H3,(H2,57,75)(H,61,72)(H,62,80)(H,63,78)(H,64,79)(H,65,81)(H,66,77)(H,67,82)(H,68,76)(H,83,84)(H4,58,59,60)/b33-4+ |
| InChIKey | DZEDKIWBMHHOHO-CCTIHRSFSA-N |
| Mol Weight | 1227.8 g/mol |
| Molecular Formula | C53H87ClN14O17 |
| Exact Mass | 1226.606215 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BeZyFNYLuXD |
|---|---|
| Name | Syringomycin |
| Comments | BRUKER AM-600 OR ACP-300 SPECTROMETER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C53H87ClN14O17 |
| InChI | InChI=1S/C53H87ClN14O17/c1-3-5-6-7-8-9-13-17-31(70)25-40(72)61-39(29-85-41(73)26-32(71)27-54)51(82)67-38(28-69)50(81)65-36(20-22-56)48(79)64-35(19-21-55)47(78)63-34(18-14-23-60-53(58)59)46(77)66-37(24-30-15-11-10-12-16-30)49(80)62-33(4-2)45(76)68-42(44(57)75)43(74)52(83)84/h4,10-12,15-16,31-32,34-39,42-43,69-71,74H,3,5-9,13-14,17-29,55-56H2,1-2H3,(H2,57,75)(H,61,72)(H,62,80)(H,63,78)(H,64,79)(H,65,81)(H,66,77)(H,67,82)(H,68,76)(H,83,84)(H4,58,59,60)/b33-4+ |
| InChIKey | DZEDKIWBMHHOHO-CCTIHRSFSA-N |
| Instrument Name | see comment |
| Literature Reference | N. Fukuchi, A. Isogai, J. Nakayama, J. Chem. Soc. Perkin I 1149 (1992). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | not reported |