| SpectraBase Compound ID | 2lE9JW4Clo5 |
|---|---|
| InChI | InChI=1S/C22H30O7/c1-10-12-7-13(24)15-21(8-12,17(10)28-11(2)23)19(26)29-14-5-6-20(3,4)16-18(25)27-9-22(14,15)16/h12-18,24-25H,1,5-9H2,2-4H3/t12-,13+,14+,15-,16-,17-,18?,21+,22+/m1/s1 |
| InChIKey | JUJKSMRAYVDOKO-ZGMLRDMUSA-N |
| Mol Weight | 406.48 g/mol |
| Molecular Formula | C22H30O7 |
| Exact Mass | 406.199153 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9anWFmEfiBr |
|---|---|
| Name | SCULPONEATIN_E |
| CAS Registry Number | 374809-50-4 |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H30O7 |
| InChI | InChI=1S/C22H30O7/c1-10-12-7-13(24)15-21(8-12,17(10)28-11(2)23)19(26)29-14-5-6-20(3,4)16-18(25)27-9-22(14,15)16/h12-18,24-25H,1,5-9H2,2-4H3/t12-,13+,14+,15-,16-,17-,18?,21+,22+/m1/s1 |
| InChIKey | JUJKSMRAYVDOKO-ZGMLRDMUSA-N |
| Literature Reference Author | B.JIANG,A.HOU,M.LI,S.LI,Q.HAN,S.WANG,Z.LIN,H.SUN |
| Literature Reference Citation | PLANTA.MED.,68,921(2002) |
| Literature Reference DOI | 10.1055/s-2002-34921 |
| Molecular Weight | 406.476 g/mol |
| Solvent | C5D5N |
| Source File Reference | UIAP1846 |