| SpectraBase Compound ID | F9ZWKCtFhRo |
|---|---|
| InChI | InChI=1S/C42H74O4/c1-10-11-12-13-14-15-16-17-18-19-37(44)46-36-25-26-39(6)34(38(36,4)5)24-28-41(8)35(39)21-20-31-32(22-27-40(31,41)7)42(9,45)29-23-33(43)30(2)3/h31-36,43,45H,2,10-29H2,1,3-9H3 |
| InChIKey | XNRKIMUVDMXMIV-UHFFFAOYSA-N |
| Mol Weight | 643.1 g/mol |
| Molecular Formula | C42H74O4 |
| Exact Mass | 642.558711 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AjT63GneMQQ |
|---|---|
| Name | FOUQUIEROL_3-LAURATE |
| Compound Number | 15A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H74O4 |
| InChI | InChI=1S/C42H74O4/c1-10-11-12-13-14-15-16-17-18-19-37(44)46-36-25-26-39(6)34(38(36,4)5)24-28-41(8)35(39)21-20-31-32(22-27-40(31,41)7)42(9,45)29-23-33(43)30(2)3/h31-36,43,45H,2,10-29H2,1,3-9H3 |
| InChIKey | XNRKIMUVDMXMIV-UHFFFAOYSA-N |
| Literature Reference Author | T.J.SCHMIDT,J.VONRAISON,G.WILLUHN |
| Literature Reference Citation | PLANTA.MED.,70,967(2004) |
| Literature Reference DOI | 10.1055/s-2004-832624 |
| Molecular Weight | 643.047 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ48518 |