| SpectraBase Compound ID | LTDfKcHlGgD |
|---|---|
| InChI | InChI=1S/C40H56O/c1-30(18-13-20-32(3)23-25-36-34(5)22-15-28-39(36,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-37-35(6)38(41)27-29-40(37,9)10/h11-14,16-17,19-26,38,41H,15,18,27-29H2,1-10H3/p+1/b12-11+,19-14+,20-13+,26-24+,30-16+,31-17+,32-23+,33-21+,36-25+ |
| InChIKey | KIDAVGZSGUYTPX-MRSLQTCCSA-O |
| Mol Weight | 553.9 g/mol |
| Molecular Formula | C40H57O |
| Exact Mass | 553.440941 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3uHt5yDvDO1 |
|---|---|
| Name | KIDAVGZSGUYTPX-MRSLQTCCSA-O |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H57O |
| InChI | InChI=1S/C40H56O/c1-30(18-13-20-32(3)23-25-36-34(5)22-15-28-39(36,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-37-35(6)38(41)27-29-40(37,9)10/h11-14,16-17,19-26,38,41H,15,18,27-29H2,1-10H3/p+1/b12-11+,19-14+,20-13+,26-24+,30-16+,31-17+,32-23+,33-21+,36-25+ |
| InChIKey | KIDAVGZSGUYTPX-MRSLQTCCSA-O |
| Literature Reference Author | B.F.LUTNAES,G.KILDAHL-ANDERSEN,J.KRANE,S.LIAAEN-JENSEN |
| Literature Reference Citation | J.AM.CHEM.SOC.,126,8981(2004) |
| Literature Reference DOI | 10.1021/ja0492541 |
| Molecular Weight | 553.892 g/mol |
| Solvent | CD2Cl2 |
| Source File Reference | UWVN31466 |