| SpectraBase Compound ID | 9Vr30BfNh0f |
|---|---|
| InChI | InChI=1S/C37H68O8/c1-3-4-5-15-19-30(38)20-17-22-33(41)35-25-26-36(45-35)34(42)24-23-32(40)31(39)21-16-13-11-9-7-6-8-10-12-14-18-29-27-28(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 | HCSSMEMSGLDFIN-LZZPYBDSSA-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 | 6QmH9jsxHF4 |
|---|---|
| Name | SQUADIOLIN_A |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H68O8 |
| InChI | InChI=1S/C37H68O8/c1-3-4-5-15-19-30(38)20-17-22-33(41)35-25-26-36(45-35)34(42)24-23-32(40)31(39)21-16-13-11-9-7-6-8-10-12-14-18-29-27-28(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 | HCSSMEMSGLDFIN-LZZPYBDSSA-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 | 28189 |
| Solvent | CDCl3 |