| SpectraBase Compound ID | F7O7I4kxrEm |
|---|---|
| InChI | InChI=1S/C27H33NO3/c1-25(2,30)24-21(29)14-18-19-10-9-15-13-17-16-7-5-6-8-20(16)28-23(17)27(15,4)26(19,3)12-11-22(18)31-24/h5-8,14-15,19,22,24,28,30H,9-13H2,1-4H3/t15-,19?,22-,24-,26-,27+/m0/s1 |
| InChIKey | GYSZYWSJZCKCBD-WZNHOQSJSA-N |
| Mol Weight | 419.6 g/mol |
| Molecular Formula | C27H33NO3 |
| Exact Mass | 419.246044 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6owSHH1Ms3C |
|---|---|
| Name | Dehydroxypaxilline |
| CAS Registry Number | 112900-05-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H33NO3 |
| InChI | InChI=1S/C27H33NO3/c1-25(2,30)24-21(29)14-18-19-10-9-15-13-17-16-7-5-6-8-20(16)28-23(17)27(15,4)26(19,3)12-11-22(18)31-24/h5-8,14-15,19,22,24,28,30H,9-13H2,1-4H3/t15-,19?,22-,24-,26-,27+/m0/s1 |
| InChIKey | GYSZYWSJZCKCBD-WZNHOQSJSA-N |
| Molecular Weight | 419.565 g/mol |
| SMILES | OC([C@@]1(C(C=C2C3[C@@]([C@]4(c5c(C[C@@]4(CC3)[H])c3ccccc3[nH]5)C)(CC[C@@]2(O1)[H])C)=O)[H])(C)C |
| SPLASH | splash10-01pk-0409300000-da01bf8dc94d602c8e6b |
| Source of Spectrum | KC-1988-2609-5 |
| Wiley ID | 1377673 |