| SpectraBase Compound ID | L1BmeSWcOAI |
|---|---|
| InChI | InChI=1S/C31H46O6/c1-18-27-26(36-31(18)14-13-28(4,37-31)17-34-19(2)32)16-25-23-8-7-21-15-22(35-20(3)33)9-11-29(21,5)24(23)10-12-30(25,27)6/h7,18,22-27H,8-17H2,1-6H3/t18-,22-,23+,24-,25-,26-,27-,28-,29-,30-,31-/m0/s1 |
| InChIKey | KKBVNPPUTWMILP-FSADBFPSSA-N |
| Mol Weight | 514.7 g/mol |
| Molecular Formula | C31H46O6 |
| Exact Mass | 514.329439 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9zIjOLyQeqG |
|---|---|
| Name | NUATIGENIN-ACETAT=(25S)-3-BETA,26-DIACETOXY-FUROSPIROST-5-EN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H46O6 |
| InChI | InChI=1S/C31H46O6/c1-18-27-26(36-31(18)14-13-28(4,37-31)17-34-19(2)32)16-25-23-8-7-21-15-22(35-20(3)33)9-11-29(21,5)24(23)10-12-30(25,27)6/h7,18,22-27H,8-17H2,1-6H3/t18-,22-,23+,24-,25-,26-,27-,28-,29-,30-,31-/m0/s1 |
| InChIKey | KKBVNPPUTWMILP-FSADBFPSSA-N |
| Literature Reference Author | P.K.AGRAWAL,D.C.JAIN,R.K.GUPTA,R.S.THAKUR |
| Literature Reference Citation | PHYTOCHEM.,24,2479(1985) |
| Literature Reference DOI | 10.1016/S0031-9422(00)80653-6 |
| Molecular Weight | 514.703 g/mol |
| Solvent | Unknown |
| Source File Reference | UNIW17130 |