| SpectraBase Compound ID | 4qhXGYh7Y5E |
|---|---|
| InChI | InChI=1S/C37H44O16/c1-18(38)46-17-33-23(13-25(42)44-8)31(6)16-35(33)37(50-21(4)41,28(31)47-19(2)39)29(48-20(3)40)36-24-14-26(43)49-27(22-9-12-45-15-22)30(24,5)10-11-34(33,36)51-32(7,52-35)53-36/h9,12,15,23-24,27-29H,10-11,13-14,16-17H2,1-8H3/t23-,24+,27-,28-,29-,30+,31+,32?,33-,34-,35-,36+,37-/m0/s1 |
| InChIKey | PJCCXGXHENUWMB-CGRGEFCCSA-N |
| Mol Weight | 744.7 g/mol |
| Molecular Formula | C37H44O16 |
| Exact Mass | 744.262935 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 26UXfiuV2Hz |
|---|---|
| Name | LEANDREANIN-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H44O16 |
| InChI | InChI=1S/C37H44O16/c1-18(38)46-17-33-23(13-25(42)44-8)31(6)16-35(33)37(50-21(4)41,28(31)47-19(2)39)29(48-20(3)40)36-24-14-26(43)49-27(22-9-12-45-15-22)30(24,5)10-11-34(33,36)51-32(7,52-35)53-36/h9,12,15,23-24,27-29H,10-11,13-14,16-17H2,1-8H3/t23-,24+,27-,28-,29-,30+,31+,32?,33-,34-,35-,36+,37-/m0/s1 |
| InChIKey | PJCCXGXHENUWMB-CGRGEFCCSA-N |
| Literature Reference Author | P.H.COOMBES,D.A.MULHOLLAND,M.RANDRIANARIVELOJOSIA |
| Literature Reference Citation | J.NAT.PROD.,66,735(2003) |
| Literature Reference DOI | 10.1021/np020481v |
| Molecular Weight | 744.747 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI7820 |