| SpectraBase Compound ID | K75Wvn7Qb00 |
|---|---|
| InChI | InChI=1S/2C25H44O4/c2*1-19(2)11-8-12-20(3)13-9-14-21(4)15-10-17-25(6)18-16-23(28-29-25)22(5)24(26)27-7/h11,13,21-23H,8-10,12,14-18H2,1-7H3;11-12,21-23H,8-10,13-18H2,1-7H3/b20-13+;20-12+/t21?,22-,23+,25-;21?,22-,23-,25+/m00/s1 |
| InChIKey | XNKAWPONMNDATI-DZADPYKRSA-N |
| Mol Weight | 408.6 g/mol |
| Molecular Formula | C25H44O4 |
| Exact Mass | 408.32396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CsADEmS0xaQ |
|---|---|
| Name | MIXTURE_OF_ISOMERS_DELTA-13,14_AND_DELTA-14,15 |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H44O4 |
| InChI | InChI=1S/2C25H44O4/c2*1-19(2)11-8-12-20(3)13-9-14-21(4)15-10-17-25(6)18-16-23(28-29-25)22(5)24(26)27-7/h11,13,21-23H,8-10,12,14-18H2,1-7H3;11-12,21-23H,8-10,13-18H2,1-7H3/b20-13+;20-12+/t21?,22-,23+,25-;21?,22-,23-,25+/m00/s1 |
| InChIKey | XNKAWPONMNDATI-DZADPYKRSA-N |
| Literature Reference Author | S.P.B.OVENDEN,R.J.CAPON |
| Literature Reference Citation | J.NAT.PROD.,62,214(1999) |
| Literature Reference DOI | 10.1021/np980223r |
| Molecular Weight | 408.622 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ2655 |