| SpectraBase Compound ID | JqkrfRaVnDF |
|---|---|
| InChI | InChI=1S/C48H68O4/c49-48(42-34-30-26-22-18-14-10-6-5-9-13-17-21-25-29-33-39-47-41-37-45-51-47)52-43-35-31-27-23-19-15-11-7-3-1-2-4-8-12-16-20-24-28-32-38-46-40-36-44-50-46/h36-37,40-41,44-45H,1-7,9-11,13,15,17,19,21,23-25,27-35,38-39,42-43H2 |
| InChIKey | IIMUYKPOBAQTRX-UHFFFAOYSA-N |
| Mol Weight | 709.1 g/mol |
| Molecular Formula | C48H68O4 |
| Exact Mass | 708.511761 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IhlotRP95qj |
|---|---|
| Name | 21-(2-FURYL)-HENEICOSA-14,16-DIYNE-19-(2-FURYL)-NONADECA-5,7-DIYONATE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H68O4 |
| InChI | InChI=1S/C48H68O4/c49-48(42-34-30-26-22-18-14-10-6-5-9-13-17-21-25-29-33-39-47-41-37-45-51-47)52-43-35-31-27-23-19-15-11-7-3-1-2-4-8-12-16-20-24-28-32-38-46-40-36-44-50-46/h36-37,40-41,44-45H,1-7,9-11,13,15,17,19,21,23-25,27-35,38-39,42-43H2 |
| InChIKey | IIMUYKPOBAQTRX-UHFFFAOYSA-N |
| Literature Reference Author | S.KANOKMEDHAKUL,K.KANOKMEDHAKUL,I.KANTIKEAW,N.PHONKERD |
| Literature Reference Citation | J.NAT.PROD.,69,68(2006) |
| Literature Reference DOI | 10.1021/np0503202 |
| Molecular Weight | 709.066 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ16814 |