| SpectraBase Compound ID | 1QQ3rwrout |
|---|---|
| InChI | InChI=1S/C33H45NO7/c1-18-24(36)16-22-29(38)27-19(2)25(41-26(37)17-23(34(7)8)21-12-10-9-11-13-21)14-15-33(27,6)31(39)30(40-20(3)35)28(18)32(22,4)5/h9-13,22-23,25,27,29-31,38-39H,2,14-17H2,1,3-8H3/t22-,23?,25-,27-,29+,30+,31-,33+/m0/s1 |
| InChIKey | BJUSJVLOCSEFRP-ONUBEPQKSA-N |
| Mol Weight | 567.7 g/mol |
| Molecular Formula | C33H45NO7 |
| Exact Mass | 567.319603 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DX8XF3xq8ED |
|---|---|
| Name | BJUSJVLOCSEFRP-ONUBEPQKSA-N |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H45NO7 |
| InChI | InChI=1S/C33H45NO7/c1-18-24(36)16-22-29(38)27-19(2)25(41-26(37)17-23(34(7)8)21-12-10-9-11-13-21)14-15-33(27,6)31(39)30(40-20(3)35)28(18)32(22,4)5/h9-13,22-23,25,27,29-31,38-39H,2,14-17H2,1,3-8H3/t22-,23?,25-,27-,29+,30+,31-,33+/m0/s1 |
| InChIKey | BJUSJVLOCSEFRP-ONUBEPQKSA-N |
| Literature Reference Author | L.H.D.JENNISKENS,E.L.M.VANROZENDAAL,T.A.VANBEEK,P.H.G.WIEGER INCK,H.W.SCHEEREN |
| Literature Reference Citation | J.NAT.PROD.,59,117(1996) |
| Literature Reference DOI | 10.1021/np960033l |
| Molecular Weight | 567.723 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP2550 |