| SpectraBase Compound ID | IiitZWA2v4D |
|---|---|
| InChI | InChI=1S/C38H60O8/c1-9-10-11-12-13-14-15-16-17-18-29(40)46-37-21-25(5)36-20-24(4)33(45-34(43)26(6)23(2)3)38(36,44)31(41)27(22-39)19-28(32(36)42)30(37)35(37,7)8/h19-20,23,25-26,28,30-31,33,39,41,44H,9-18,21-22H2,1-8H3/t25?,26?,28-,30?,31?,33?,36+,37?,38?/m0/s1 |
| InChIKey | HAZRIGCVIAWJTI-NCBCQWOOSA-N |
| Mol Weight | 644.9 g/mol |
| Molecular Formula | C38H60O8 |
| Exact Mass | 644.428819 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GBIC4sHsgvt |
|---|---|
| Name | 3-O-(2,3-DIMETHYLBUTYRYL)-13-O-DODECANOYL-13-HYDROXY-INGENOL |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H60O8 |
| InChI | InChI=1S/C38H60O8/c1-9-10-11-12-13-14-15-16-17-18-29(40)46-37-21-25(5)36-20-24(4)33(45-34(43)26(6)23(2)3)38(36,44)31(41)27(22-39)19-28(32(36)42)30(37)35(37,7)8/h19-20,23,25-26,28,30-31,33,39,41,44H,9-18,21-22H2,1-8H3/t25?,26?,28-,30?,31?,33?,36+,37?,38?/m0/s1 |
| InChIKey | HAZRIGCVIAWJTI-NCBCQWOOSA-N |
| Literature Reference Author | T.MATSUMOTO,J.-C.CYONG,H.YAMADA |
| Literature Reference Citation | PLANTA.MED.,58,255(1992) |
| Literature Reference DOI | 10.1055/s-2006-961447 |
| Molecular Weight | 644.890 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UIAP320 |