SpectraBase Compound ID | Ll20ScJ66cR |
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InChI | InChI=1S/C32H45NO8/c1-33-16-29(17-36-2)13-12-20(37-3)32-19-14-30(35)21(38-4)15-31(40-6,23(26(32)33)24(39-5)25(29)32)22(19)27(30)41-28(34)18-10-8-7-9-11-18/h7-11,19-27,35H,12-17H2,1-6H3/t19?,20-,21-,22?,23-,24?,25+,26?,27+,29-,30-,31+,32-/m0/s1 |
InChIKey | UCDKRVJEXMQBET-VBQCPDKSSA-N |
Mol Weight | 571.7 g/mol |
Molecular Formula | C32H45NO8 |
Exact Mass | 571.314517 g/mol |
SpectraBase Spectrum ID | A5LNSdcR5GY |
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Name | 8-Deacetyl-8-O-Methyl -Delphinine |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C32H45NO8 |
InChI | InChI=1S/C32H45NO8/c1-33-16-29(17-36-2)13-12-20(37-3)32-19-14-30(35)21(38-4)15-31(40-6,23(26(32)33)24(39-5)25(29)32)22(19)27(30)41-28(34)18-10-8-7-9-11-18/h7-11,19-27,35H,12-17H2,1-6H3/t19?,20-,21-,22?,23-,24?,25+,26?,27+,29-,30-,31+,32-/m0/s1 |
InChIKey | UCDKRVJEXMQBET-VBQCPDKSSA-N |
Molecular Weight | 571.711 g/mol |
SMILES | O[C@]12CC3C([C@@](C[C@@]2(OC)[H])(OC)[C@@]2(C4[C@@]33[C@@]([C@@](CN4C)(COC)CC[C@@]3(OC)[H])(C2OC)[H])[H])[C@]1(OC(=O)c1ccccc1)[H] |
SPLASH | splash10-0006-9400010000-623f92d9154e7e72eea3 |
Source of Spectrum | X2-52-724-5 |
Wiley ID | 1603154 |