| SpectraBase Compound ID | K7VNT0JrwIV |
|---|---|
| InChI | InChI=1S/C23H30O6/c1-22-10-9-14(24)11-13(22)3-4-15-16-5-6-18(25)23(16,2)12-17(21(15)22)29-20(28)8-7-19(26)27/h11,15-17,21H,3-10,12H2,1-2H3,(H,26,27)/t15-,16-,17+,21+,22-,23-/m0/s1 |
| InChIKey | NOALTCHZPRZGCP-SUMFRYMYSA-N |
| Mol Weight | 402.49 g/mol |
| Molecular Formula | C23H30O6 |
| Exact Mass | 402.204239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4kMBHDBV6BU |
|---|---|
| Name | 3,17-Dioxo-4-androsten-11ALPHA-yl hydrogen succinate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 402.204238680 u |
| Formula | C23H30O6 |
| InChI | InChI=1S/C23H30O6/c1-22-10-9-14(24)11-13(22)3-4-15-16-5-6-18(25)23(16,2)12-17(21(15)22)29-20(28)8-7-19(26)27/h11,15-17,21H,3-10,12H2,1-2H3,(H,26,27)/t15-,16-,17+,21+,22-,23-/m0/s1 |
| InChIKey | NOALTCHZPRZGCP-SUMFRYMYSA-N |
| Molecular Weight | 402.487 g/mol |
| SMILES | C1(CC[C@]2(C(=C1)CC[C@@]1([C@@]2([C@@](C[C@]2([C@]1(CCC2=O)[H])C)(OC(=O)CCC(O)=O)[H])[H])[H])C)=O |