| SpectraBase Compound ID | BIsxjhvOZ1f |
|---|---|
| InChI | InChI=1S/C28H40O8/c1-19-16-22(14-15-35-18-21-10-12-23(33-3)13-11-21)27(32)28(34-4)25(30)17-26(31)36-20(2)8-6-5-7-9-24(19)29/h5-7,9-13,19-20,22,25,27-28,30,32H,8,14-18H2,1-4H3/b6-5+,9-7+/t19-,20-,22+,25-,27+,28+/m1/s1 |
| InChIKey | RQLDXIARZCFUOS-DEEPRGMYSA-N |
| Mol Weight | 504.6 g/mol |
| Molecular Formula | C28H40O8 |
| Exact Mass | 504.272318 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | F5FJ9TN3oMH |
|---|---|
| Name | 6"-Dihydro-6"-O-(4-methoxybenzyl)niddanolide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H40O8 |
| InChI | InChI=1S/C28H40O8/c1-19-16-22(14-15-35-18-21-10-12-23(33-3)13-11-21)27(32)28(34-4)25(30)17-26(31)36-20(2)8-6-5-7-9-24(19)29/h5-7,9-13,19-20,22,25,27-28,30,32H,8,14-18H2,1-4H3/b6-5+,9-7+/t19-,20-,22+,25-,27+,28+/m1/s1 |
| InChIKey | RQLDXIARZCFUOS-DEEPRGMYSA-N |
| Molecular Weight | 504.620 g/mol |
| SMILES | O[C@]1([C@@]([C@]([C@](C[C@](C(\C=C\C=C\C[C@](OC(C1)=O)(C)[H])=O)(C)[H])(CCOCc1ccc(cc1)OC)[H])(O)[H])(OC)[H])[H] |
| SPLASH | splash10-00di-0900000000-3b1acc3f9ed2f62065c9 |
| Source of Spectrum | E1-39-2827-23 |
| Wiley ID | 1519193 |