| SpectraBase Compound ID | DzLkxJ8tg3r |
|---|---|
| InChI | InChI=1S/C27H38ClNO7/c1-6-7-8-9-10-16(2)13-17(3)11-12-22(32)29-21-15-27(36-26(21)34-19(5)31)14-20(28)23(33-18(4)30)24-25(27)35-24/h11-14,16,21,23-26H,6-10,15H2,1-5H3,(H,29,32)/b12-11+,17-13+/t16-,21+,23+,24+,25+,26-,27+/m1/s1 |
| InChIKey | OVTGCWNEQGQFKT-UBJAVSGJSA-N |
| Mol Weight | 524.1 g/mol |
| Molecular Formula | C27H38ClNO7 |
| Exact Mass | 523.23368 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gy8uRtC3IB4 |
|---|---|
| Name | GYMNASTATIN-E-DIACETATE |
| Compound Number | 8A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H38ClNO7 |
| InChI | InChI=1S/C27H38ClNO7/c1-6-7-8-9-10-16(2)13-17(3)11-12-22(32)29-21-15-27(36-26(21)34-19(5)31)14-20(28)23(33-18(4)30)24-25(27)35-24/h11-14,16,21,23-26H,6-10,15H2,1-5H3,(H,29,32)/b12-11+,17-13+/t16-,21+,23+,24+,25+,26-,27+/m1/s1 |
| InChIKey | OVTGCWNEQGQFKT-UBJAVSGJSA-N |
| Literature Reference Author | T.AMAGATA,M.DOI,T.OHTA,K.MINOURA,A.NUMATA |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,3585(1998) |
| Literature Reference DOI | 10.1039/a804466j |
| Molecular Weight | 524.054 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP9047 |