| SpectraBase Compound ID | HJPZDJGhnXM |
|---|---|
| InChI | InChI=1S/C30H46O3/c1-19(10-9-14-26(2,3)33)20-13-15-30(8)25-23(31)18-22-21(11-12-24(32)27(22,4)5)28(25,6)16-17-29(20,30)7/h9,14,18-21,25,33H,10-13,15-17H2,1-8H3/b14-9+/t19-,20-,21?,25?,28+,29-,30+/m1/s1 |
| InChIKey | PFROKAUESVZIJA-BKUVFLRVSA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C30H46O3 |
| Exact Mass | 454.344695 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 55c6jd8x04 |
|---|---|
| Name | (23E)-25-Hydroxy-Cucurbita-5,23-diene-3,7-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H46O3 |
| InChI | InChI=1S/C30H46O3/c1-19(10-9-14-26(2,3)33)20-13-15-30(8)25-23(31)18-22-21(11-12-24(32)27(22,4)5)28(25,6)16-17-29(20,30)7/h9,14,18-21,25,33H,10-13,15-17H2,1-8H3/b14-9+/t19-,20-,21?,25?,28+,29-,30+/m1/s1 |
| InChIKey | PFROKAUESVZIJA-BKUVFLRVSA-N |
| Molecular Weight | 454.695 g/mol |
| SMILES | OC(\C=C\C[C@]([C@@]1([C@@]2([C@](C3[C@@](C4C(C(C(=O)CC4)(C)C)=CC3=O)(C)CC2)(CC1)C)C)[H])(C)[H])(C)C |
| SPLASH | splash10-00dj-7911000000-8fab7941bbc7b670aa60 |
| Source of Spectrum | G4-69-1170-3 |
| Wiley ID | 1694409 |