| SpectraBase Compound ID | ITFVmfEjxeR |
|---|---|
| InChI | InChI=1S/C30H42O9/c1-14(2)26(34)38-25-17(6)29(36)21-9-16(5)23(33)20(21)10-19(12-31)11-22(29)24-28(8,13-37-18(7)32)30(24,25)39-27(35)15(3)4/h9,11,14-15,17,20-22,24-25,31,36H,10,12-13H2,1-8H3/t17-,20+,21-,22+,24-,25-,28+,29+,30-/m1/s1 |
| InChIKey | IADCEPPDLBTECH-ADOCXEFDSA-N |
| Mol Weight | 546.7 g/mol |
| Molecular Formula | C30H42O9 |
| Exact Mass | 546.282883 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2AqhBSXvpVh |
|---|---|
| Name | 17-ACETOXY-4-DEOXY-PHORBOL-12,13-BIS-(ISOBUTYRATE) |
| Compound Number | 118 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H42O9 |
| InChI | InChI=1S/C30H42O9/c1-14(2)26(34)38-25-17(6)29(36)21-9-16(5)23(33)20(21)10-19(12-31)11-22(29)24-28(8,13-37-18(7)32)30(24,25)39-27(35)15(3)4/h9,11,14-15,17,20-22,24-25,31,36H,10,12-13H2,1-8H3/t17-,20+,21-,22+,24-,25-,28+,29+,30-/m1/s1 |
| InChIKey | IADCEPPDLBTECH-ADOCXEFDSA-N |
| Literature Reference Author | Q.C.WU,Y.P.TANG,A.W.DING,F.Q.YOU,L.ZHANG,J.A.DUAN |
| Literature Reference Citation | MOLECULES,14,4454(2009) |
| Literature Reference DOI | 10.3390/molecules14114454 |
| Molecular Weight | 546.658 g/mol |
| Sample ID | 69998 |
| Solvent | CDCl3 |