| SpectraBase Compound ID | CyBTMX6qm8j |
|---|---|
| InChI | InChI=1S/C25H44N14O7/c1-11-18(40)36-15(9-33-19(41)12(27)4-2-3-6-26)21(43)37-16(10-34-25(30)46)22(44)39-17(14-5-7-31-24(29)38-14)23(45)32-8-13(28)20(42)35-11/h10-15,17H,2-9,26-28H2,1H3,(H,32,45)(H,33,41)(H,35,42)(H,36,40)(H,37,43)(H,39,44)(H3,29,31,38)(H3,30,34,46)/b16-10-/t11-,12?,13-,14?,15-,17-/m0/s1 |
| InChIKey | ZIUAYPIMJNYILS-DIZQSZQRSA-N |
| Mol Weight | 652.7 g/mol |
| Molecular Formula | C25H44N14O7 |
| Exact Mass | 652.35174 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DLCaEaAxcAV |
|---|---|
| Name | LABELLED;DL-SERINE;DL-ALANINE;CAPREOMYCIN-IB |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H44N14O7 |
| InChI | InChI=1S/C25H44N14O7/c1-11-18(40)36-15(9-33-19(41)12(27)4-2-3-6-26)21(43)37-16(10-34-25(30)46)22(44)39-17(14-5-7-31-24(29)38-14)23(45)32-8-13(28)20(42)35-11/h10-15,17H,2-9,26-28H2,1H3,(H,32,45)(H,33,41)(H,35,42)(H,36,40)(H,37,43)(H,39,44)(H3,29,31,38)(H3,30,34,46)/b16-10-/t11-,12?,13-,14?,15-,17-/m0/s1 |
| InChIKey | ZIUAYPIMJNYILS-DIZQSZQRSA-N |
| Literature Reference Author | M.WANG,S.J.GOULD |
| Literature Reference Citation | J.ORG.CHEM.,58,5176(1993) |
| Literature Reference DOI | 10.1021/jo00071a029 |
| Molecular Weight | 652.714 g/mol |
| Solvent | D2O |
| Source File Reference | UWGE5175 |