| SpectraBase Compound ID | HlmJci1tyjQ |
|---|---|
| InChI | InChI=1S/C37H68O8/c1-3-4-5-6-7-11-14-17-20-31(38)32(39)22-23-33(40)34(41)24-25-35(42)36-26-21-30(45-36)19-16-13-10-8-9-12-15-18-29-27-28(2)44-37(29)43/h27-28,30-36,38-42H,3-26H2,1-2H3/t28-,30-,31+,32+,33+,34+,35+,36+/m1/s1 |
| InChIKey | OICKTCBVAYOJGE-SJPDIZRSSA-N |
| Mol Weight | 640.9 g/mol |
| Molecular Formula | C37H68O8 |
| Exact Mass | 640.491419 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JqDFfhD0Q7y |
|---|---|
| Name | SQUADIOLIN_B |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H68O8 |
| InChI | InChI=1S/C37H68O8/c1-3-4-5-6-7-11-14-17-20-31(38)32(39)22-23-33(40)34(41)24-25-35(42)36-26-21-30(45-36)19-16-13-10-8-9-12-15-18-29-27-28(2)44-37(29)43/h27-28,30-36,38-42H,3-26H2,1-2H3/t28-,30-,31+,32+,33+,34+,35+,36+/m1/s1 |
| InChIKey | OICKTCBVAYOJGE-SJPDIZRSSA-N |
| Literature Reference Author | C.C.LIAW,Y.L.YANG,M.CHEN,F.R.CHANG,S.L.CHEN,S.H.WU,Y.C.WU |
| Literature Reference Citation | J.NAT.PROD.,71,764(2008) |
| Literature Reference DOI | 10.1021/np0704957 |
| Molecular Weight | 640.942 g/mol |
| Sample ID | 28190 |
| Solvent | CDCl3 |