| SpectraBase Compound ID | 9exkNSDCp4T |
|---|---|
| InChI | InChI=1S/C37H54O8/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-32(38)45-35-28-23-31(44-37(28)41)33(25(4)5)30-22-27(36(40)42-6)29(43-30)21-26(24(2)3)34(35)39/h22-23,26,31,33-35,39H,2,4,7-21H2,1,3,5-6H3/t26-,31-,33+,34-,35-/m1/s1 |
| InChIKey | VBMMZFOCKDLDJI-LTCBTEPNSA-N |
| Mol Weight | 626.8 g/mol |
| Molecular Formula | C37H54O8 |
| Exact Mass | 626.381869 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EcjtGWNzVaH |
|---|---|
| Name | LIPIDYL_PSEUDOPTERANE_A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H54O8 |
| InChI | InChI=1S/C37H54O8/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-32(38)45-35-28-23-31(44-37(28)41)33(25(4)5)30-22-27(36(40)42-6)29(43-30)21-26(24(2)3)34(35)39/h22-23,26,31,33-35,39H,2,4,7-21H2,1,3,5-6H3/t26-,31-,33+,34-,35-/m1/s1 |
| InChIKey | VBMMZFOCKDLDJI-LTCBTEPNSA-N |
| Literature Reference Author | A.S.KATE,I.AUBRY,M.L.TREMBLAY,R.G.KERR |
| Literature Reference Citation | J.NAT.PROD.,71,1977(2008) |
| Literature Reference DOI | 10.1021/np800544b |
| Molecular Weight | 626.831 g/mol |
| Sample ID | 29399 |
| Solvent | CDCl3 |