| SpectraBase Compound ID | AbGPZqtZCfI |
|---|---|
| InChI | InChI=1S/C56H42O12/c57-34-10-1-28(2-11-34)3-18-43-50-46(67-54(29-4-12-35(58)13-5-29)48(50)32-19-38(61)23-39(62)20-32)27-47-51(43)53(56(68-47)31-8-16-37(60)17-9-31)44-25-42(65)26-45-52(44)49(33-21-40(63)24-41(64)22-33)55(66-45)30-6-14-36(59)15-7-30/h1-27,48-49,53-65H/b18-3+/t48-,49-,53+,54+,55+,56-/m0/s1 |
| InChIKey | GLQOGVYZTTVYKZ-HGMMQLLSSA-N |
| Mol Weight | 906.9 g/mol |
| Molecular Formula | C56H42O12 |
| Exact Mass | 906.267627 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GsOdhGDreCe |
|---|---|
| Name | FLEXUOSOL-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C56H42O12 |
| InChI | InChI=1S/C56H42O12/c57-34-10-1-28(2-11-34)3-18-43-50-46(67-54(29-4-12-35(58)13-5-29)48(50)32-19-38(61)23-39(62)20-32)27-47-51(43)53(56(68-47)31-8-16-37(60)17-9-31)44-25-42(65)26-45-52(44)49(33-21-40(63)24-41(64)22-33)55(66-45)30-6-14-36(59)15-7-30/h1-27,48-49,53-65H/b18-3+/t48-,49-,53+,54+,55+,56-/m0/s1 |
| InChIKey | GLQOGVYZTTVYKZ-HGMMQLLSSA-N |
| Literature Reference Author | W.W.LI,B.G.LI,Y.Z.CHEN |
| Literature Reference Citation | J.NAT.PROD.,61,646(1998) |
| Literature Reference DOI | 10.1021/np970457v |
| Molecular Weight | 906.942 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWRK3403 |
| SpectraBase Batch ID | L1Rq3WE2Xxi |