| SpectraBase Compound ID | F8b39tbL5L9 |
|---|---|
| InChI | InChI=1S/C34H47NO9/c1-19(36)44-32-15-21-24(29(32)43-30(37)20-11-9-8-10-12-20)33(42-7,16-23(32)40-5)25-26(41-6)27-31(18-38-3)14-13-22(39-4)34(21,27)28(25)35(2)17-31/h8-12,21-29H,13-18H2,1-7H3/t21?,22-,23-,24?,25-,26?,27+,28?,29+,31-,32-,33+,34-/m0/s1 |
| InChIKey | UUUURQYYECPAMD-UGBPDXNBSA-N |
| Mol Weight | 613.7 g/mol |
| Molecular Formula | C34H47NO9 |
| Exact Mass | 613.325082 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IWkOmaJ9LCO |
|---|---|
| Name | 13-O-Acetyl-8-Deacetyl-8-O-Methyl -Delphinine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H47NO9 |
| InChI | InChI=1S/C34H47NO9/c1-19(36)44-32-15-21-24(29(32)43-30(37)20-11-9-8-10-12-20)33(42-7,16-23(32)40-5)25-26(41-6)27-31(18-38-3)14-13-22(39-4)34(21,27)28(25)35(2)17-31/h8-12,21-29H,13-18H2,1-7H3/t21?,22-,23-,24?,25-,26?,27+,28?,29+,31-,32-,33+,34-/m0/s1 |
| InChIKey | UUUURQYYECPAMD-UGBPDXNBSA-N |
| Molecular Weight | 613.748 g/mol |
| SMILES | [C@]123C4[C@](C([C@@]3([C@@](CN4C)(COC)CC[C@@]2(OC)[H])[H])OC)([C@@]2(C3C1C[C@@]([C@@](OC)(C2)[H])(OC(=O)C)[C@@]3(OC(=O)c1ccccc1)[H])OC)[H] |
| SPLASH | splash10-001i-0300090000-414e96098c61a72abd94 |
| Source of Spectrum | X2-52-724-16 |
| Wiley ID | 1603153 |