SpectraBase Compound ID | 3eJa1zTefAy |
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InChI | InChI=1S/C22H36N2O5/c1-14-7-5-9-15(2)18(26)19-16(22(20(27)28-4)11-12-23-24-22)13-17(25)21(3,29-19)10-6-8-14/h8,15-19,25-26H,5-7,9-13H2,1-4H3/b14-8+/t15-,16+,17+,18-,19+,21-,22-/m0/s1 |
InChIKey | JXTBDMHBMVUUGM-DOQHUNGZSA-N |
Mol Weight | 408.5 g/mol |
Molecular Formula | C22H36N2O5 |
Exact Mass | 408.262422 g/mol |
SpectraBase Spectrum ID | CaV9BLXvnbR |
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Name | Euliolide-15-spiro-5'-pyrazoline |
Alternate Name(s) | (5S)-5-[(1R,2S,3S,7E,11S,12R,14S)-2,12-dihydroxy-3,7,11-trimethyl-15-oxabicyclo[9.3.1]pentadec-7-en-14-yl]-3,4-dihydropyrazole-5-carboxylic acid methyl ester Methyl (5S)-5-[(1R,2S,3S,7E,11S,12R,14S)-2,12-dihydroxy-3,7,11-trimethyl-15-oxabicyclo[9.3.1]pentadec-7-en-14-yl]-3,4-dihydropyrazole-5-carboxylate Methyl (5S)-5-[(1R,2S,3S,7E,11S,12R,14S)-3,7,11-trimethyl-2,12-bis(oxidanyl)-15-oxabicyclo[9.3.1]pentadec-7-en-14-yl]-3,4-dihydropyrazole-5-carboxylate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C22H36N2O5 |
InChI | InChI=1S/C22H36N2O5/c1-14-7-5-9-15(2)18(26)19-16(22(20(27)28-4)11-12-23-24-22)13-17(25)21(3,29-19)10-6-8-14/h8,15-19,25-26H,5-7,9-13H2,1-4H3/b14-8+/t15-,16+,17+,18-,19+,21-,22-/m0/s1 |
InChIKey | JXTBDMHBMVUUGM-DOQHUNGZSA-N |
Molecular Weight | 408.539 g/mol |
SMILES | O[C@@]1(C[C@]([C@@]2([C@]([C@](CCC\C(=C\CC[C@]1(C)O2)C)(C)[H])(O)[H])[H])([C@]1(N=NCC1)C(=O)OC)[H])[H] |
SPLASH | splash10-0532-9305000000-cfd64cf46c058a6beff4 |
Source of Spectrum | J-66-656-24 |
Wiley ID | 1534319 |