| SpectraBase Compound ID | FjtTohLBbzN |
|---|---|
| InChI | InChI=1S/C46H69NO8/c1-6-7-8-9-10-11-12-13-14-15-16-17-21-24-35(48)55-45-28-27-44(50)29-33(36(45)41(44)54-42(49)32-22-19-18-20-23-32)46-34(52-4)25-26-43(31-51-3)30-47(2)40(46)37(45)38(53-5)39(43)46/h18-20,22-23,27-28,33-34,36-41,50H,6-17,21,24-26,29-31H2,1-5H3/t33?,34?,36?,37?,38?,39?,40?,41?,43-,44+,45+,46?/m0/s1 |
| InChIKey | GGTABWBUUVORBL-IQQAAMQLSA-N |
| Mol Weight | 764.1 g/mol |
| Molecular Formula | C46H69NO8 |
| Exact Mass | 763.502318 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5mIFSZVVRtZ |
|---|---|
| Name | 16-Demethoxy-15,16-didehydro-14-Benzoyl-Delphonine-8-Palmitate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C46H69NO8 |
| InChI | InChI=1S/C46H69NO8/c1-6-7-8-9-10-11-12-13-14-15-16-17-21-24-35(48)55-45-28-27-44(50)29-33(36(45)41(44)54-42(49)32-22-19-18-20-23-32)46-34(52-4)25-26-43(31-51-3)30-47(2)40(46)37(45)38(53-5)39(43)46/h18-20,22-23,27-28,33-34,36-41,50H,6-17,21,24-26,29-31H2,1-5H3/t33?,34?,36?,37?,38?,39?,40?,41?,43-,44+,45+,46?/m0/s1 |
| InChIKey | GGTABWBUUVORBL-IQQAAMQLSA-N |
| Molecular Weight | 764.057 g/mol |
| SMILES | O[C@]12C=C[C@@]3(C4C5N(C[C@]6(C(C4OC)C5(C(C3C2OC(=O)c2ccccc2)C1)C(CC6)OC)COC)C)OC(=O)CCCCCCCCCCCCCCC |
| SPLASH | splash10-052f-9510000100-95b985de4a540699d306 |
| Source of Spectrum | X2-57-969-14 |
| Wiley ID | 1605575 |