SpectraBase Compound ID | EZ6eTM97x5L |
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InChI | InChI=1S/C31H39N3O5/c1-34-11-7-17-12-24(38-4)28(35)27-26(17)21(34)15-30(27)8-9-31(25(16-30)39-5)29-18(6-10-32-31)19-13-22(36-2)23(37-3)14-20(19)33-29/h12-14,21,25,32-33,35H,6-11,15-16H2,1-5H3/t21?,25-,30+,31+/m1/s1 |
InChIKey | ZEQJFLRBPFWVDX-LGFSPVNFSA-N |
Mol Weight | 533.7 g/mol |
Molecular Formula | C31H39N3O5 |
Exact Mass | 533.288971 g/mol |
SpectraBase Spectrum ID | KaZ8K968vM3 |
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Name | ROEMERIDINE |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C31H39N3O5 |
InChI | InChI=1S/C31H39N3O5/c1-34-11-7-17-12-24(38-4)28(35)27-26(17)21(34)15-30(27)8-9-31(25(16-30)39-5)29-18(6-10-32-31)19-13-22(36-2)23(37-3)14-20(19)33-29/h12-14,21,25,32-33,35H,6-11,15-16H2,1-5H3/t21?,25-,30+,31+/m1/s1 |
InChIKey | ZEQJFLRBPFWVDX-LGFSPVNFSA-N |
Literature Reference Author | R.MAREK,J.DOSTAL,J.SLAVIK,C.SKLENAR |
Literature Reference Citation | MOLECULES,1,166(1996) |
Literature Reference DOI | 10.1007/s007830050033 |
Molecular Weight | 533.668 g/mol |
Solvent | DMSO-D6 |
Source File Reference | UWVN7031 |