| SpectraBase Compound ID | BfssOj37GFh |
|---|---|
| InChI | InChI=1S/C39H40O10/c1-20-14-28(25-9-8-24(41)19-32(25)44)35(38(48)27-10-11-30(42)26(37(27)47)12-13-39(2,3)49)29(15-20)36-33(45)16-21(17-34(36)46)4-5-22-6-7-23(40)18-31(22)43/h4-11,15-19,28-29,35,40-47,49H,12-14H2,1-3H3/b5-4+/t28-,29+,35-/m1/s1 |
| InChIKey | MKVXRXTVDGOLCF-LYBFFQFTSA-N |
| Mol Weight | 668.7 g/mol |
| Molecular Formula | C39H40O10 |
| Exact Mass | 668.262147 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8oaNofh7uJL |
|---|---|
| Name | SOROCEIN-M |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H40O10 |
| InChI | InChI=1S/C39H40O10/c1-20-14-28(25-9-8-24(41)19-32(25)44)35(38(48)27-10-11-30(42)26(37(27)47)12-13-39(2,3)49)29(15-20)36-33(45)16-21(17-34(36)46)4-5-22-6-7-23(40)18-31(22)43/h4-11,15-19,28-29,35,40-47,49H,12-14H2,1-3H3/b5-4+/t28-,29+,35-/m1/s1 |
| InChIKey | MKVXRXTVDGOLCF-LYBFFQFTSA-N |
| Literature Reference Author | F.FERRARI,V.C.FILHO,T.CABRAS,I.MESSANA |
| Literature Reference Citation | J.NAT.PROD.,66,581(2003) |
| Literature Reference DOI | 10.1021/np020515z |
| Molecular Weight | 668.741 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWSI7667 |