| SpectraBase Compound ID | AWV1mcTHfqD |
|---|---|
| InChI | InChI=1S/C36H58O7/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-29(38)43-22-26-21-27-30-28(34(30,4)23-37)19-20-35(33(27)41)25(3)24(2)31(39)36(35,42)32(26)40/h21,27-28,30-32,37,39-40,42H,5-20,22-23H2,1-4H3/t27-,28-,30+,31+,32-,34-,35-,36-/m1/s1 |
| InChIKey | IPTVXFSRMWQATO-KWMHFABSSA-N |
| Mol Weight | 602.9 g/mol |
| Molecular Formula | C36H58O7 |
| Exact Mass | 602.418254 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dzxf0Lb93Ye |
|---|---|
| Name | 17-HYDROXYINGENOL-20-HEXADECANOATE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O7 |
| InChI | InChI=1S/C36H58O7/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-29(38)43-22-26-21-27-30-28(34(30,4)23-37)19-20-35(33(27)41)25(3)24(2)31(39)36(35,42)32(26)40/h21,27-28,30-32,37,39-40,42H,5-20,22-23H2,1-4H3/t27-,28-,30+,31+,32-,34-,35-,36-/m1/s1 |
| InChIKey | IPTVXFSRMWQATO-KWMHFABSSA-N |
| Literature Reference Author | Z.H.MBWAMBO,S.K.LEE,E.N.MSHIU,J.M.PEZZUTO,A.D.KINGHORN |
| Literature Reference Citation | J.NAT.PROD.,59,1051(1996) |
| Literature Reference DOI | 10.1021/np960412e |
| Molecular Weight | 602.852 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP903 |