| SpectraBase Compound ID | BciQKEdiIyJ |
|---|---|
| InChI | InChI=1S/C28H42O6/c1-5-17-7-9-21-20-8-6-18-14-19(10-12-28(18,4)22(20)11-13-27(17,21)3)34-26-25(31)24(30)23(15-32-26)33-16(2)29/h5-6,17,19-26,30-31H,1,7-15H2,2-4H3/t17-,19-,20?,21?,22?,23+,24+,25-,26-,27+,28-/m0/s1 |
| InChIKey | LYCUXBSMEHKLCL-OREBMLSUSA-N |
| Mol Weight | 474.6 g/mol |
| Molecular Formula | C28H42O6 |
| Exact Mass | 474.298139 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | IWluhwWRhqB |
|---|---|
| Name | 4'-O-Acetyl-3.beta.-pregna-5,20-dienyl-.beta.-D-arabinopyranoside |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H42O6 |
| InChI | InChI=1S/C28H42O6/c1-5-17-7-9-21-20-8-6-18-14-19(10-12-28(18,4)22(20)11-13-27(17,21)3)34-26-25(31)24(30)23(15-32-26)33-16(2)29/h5-6,17,19-26,30-31H,1,7-15H2,2-4H3/t17-,19-,20?,21?,22?,23+,24+,25-,26-,27+,28-/m0/s1 |
| InChIKey | LYCUXBSMEHKLCL-OREBMLSUSA-N |
| Molecular Weight | 474.638 g/mol |
| SMILES | O[C@@]1([C@@](CO[C@]([C@]1(O)[H])(O[C@@]1(CC=2[C@@](C3C(C4CC[C@@]([C@]4(CC3)C)(C=C)[H])CC2)(CC1)C)[H])[H])(OC(=O)C)[H])[H] |
| SPLASH | splash10-00lx-5590000000-22bc9b14daead4fd2836 |
| Source of Spectrum | G4-69-1383-5 |
| Wiley ID | 1694457 |