| SpectraBase Compound ID | EUPquO3wWXw |
|---|---|
| InChI | InChI=1S/C38H58O8/c1-8-9-10-11-12-13-14-15-16-17-18-19-31(41)46-34-24(2)22-37-25(3)20-30-32(36(30,6)7)29(33(37)42)21-28(23-44-26(4)39)35(38(34,37)43)45-27(5)40/h21-22,25,29-30,32,34-35,43H,8-20,23H2,1-7H3/t25-,29+,30?,32?,34+,35-,37+,38-/m1/s1 |
| InChIKey | CLEHRYYCGLFELN-RPTMGSQXSA-N |
| Mol Weight | 642.9 g/mol |
| Molecular Formula | C38H58O8 |
| Exact Mass | 642.413169 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JhflVLVxP6e |
|---|---|
| Name | 3-TETRADECANOATE-INGENOL-(5,20-DIACETATE) |
| Compound Number | 551 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C38H58O8/c1-8-9-10-11-12-13-14-15-16-17-18-19-31(41)46-34-24(2)22-37-25(3)20-30-32(36(30,6)7)29(33(37)42)21-28(23-44-26(4)39)35(38(34,37)43)45-27(5)40/h21-22,25,29-30,32,34-35,43H,8-20,23H2,1-7H3/t25-,29+,30?,32?,34+,35-,37+,38-/m1/s1 |
| InChIKey | CLEHRYYCGLFELN-RPTMGSQXSA-N |
| Literature Reference | NAT.PROD.VOL.2 A.UR-RAHMAN,V.U.AHMAD |
| Solvent | Chloroform-d |