| SpectraBase Compound ID | GE3RnqP4Ab0 |
|---|---|
| InChI | InChI=1S/C32H57N3O10S/c1-8-9-10-11-12-13-14-15-16-17-18-19-25(36)21(4)28-22(5)29(37)34-26(20(2)3)30(38)35-27(24(7)45-46(41,42)43)31(39)33-23(6)32(40)44-28/h20-22,24-28,36H,6,8-19H2,1-5,7H3,(H,33,39)(H,34,37)(H,35,38)(H,41,42,43) |
| InChIKey | ZILRHQOCEUWYFR-UHFFFAOYSA-N |
| Mol Weight | 675.9 g/mol |
| Molecular Formula | C32H57N3O10S |
| Exact Mass | 675.376466 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J5bmVDa8Ta |
|---|---|
| Name | STEVASTELIN-D-3 |
| CAS Registry Number | 182125-49-1 |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H57N3O10S |
| InChI | InChI=1S/C32H57N3O10S/c1-8-9-10-11-12-13-14-15-16-17-18-19-25(36)21(4)28-22(5)29(37)34-26(20(2)3)30(38)35-27(24(7)45-46(41,42)43)31(39)33-23(6)32(40)44-28/h20-22,24-28,36H,6,8-19H2,1-5,7H3,(H,33,39)(H,34,37)(H,35,38)(H,41,42,43) |
| InChIKey | ZILRHQOCEUWYFR-UHFFFAOYSA-N |
| Literature Reference Author | T.MORINO,K.I.SHIMADA,A.MASUDA,M.NISHIMOTO,S.SAITO |
| Literature Reference Citation | J.ANTIBIOTICS,49,1049(1996) |
| Literature Reference DOI | 10.7164/antibiotics.49.1049 |
| Molecular Weight | 675.879 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMP15 |