| SpectraBase Compound ID | CzObpiHJT9w |
|---|---|
| InChI | InChI=1S/C25H37IO7/c1-14(32-15(2)27)19-5-6-20-18(13-26)21(8-9-24(19,20)4)25(12-23(30)31)10-7-17(11-22(25)29)33-16(3)28/h14,17-21H,5-13H2,1-4H3,(H,30,31)/t14?,17-,18?,19?,20?,21?,24?,25?/m1/s1 |
| InChIKey | OCQKWWOCLKPGNX-MFXMFPOSSA-N |
| Mol Weight | 576.5 g/mol |
| Molecular Formula | C25H37IO7 |
| Exact Mass | 576.158399 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | hZKF0HP6vg |
|---|---|
| Name | 3-beta-20-beta-BIS-(ACETOXY)-19-FORMYLOXY-7-IODO-6-NOR-5,7-SECO-PREGNAN-5-ONE |
| Compound Number | 2B |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C25H37IO7/c1-14(32-15(2)27)19-5-6-20-18(13-26)21(8-9-24(19,20)4)25(12-23(30)31)10-7-17(11-22(25)29)33-16(3)28/h14,17-21H,5-13H2,1-4H3,(H,30,31)/t14?,17-,18?,19?,20?,21?,24?,25?/m1/s1 |
| InChIKey | OCQKWWOCLKPGNX-MFXMFPOSSA-N |
| Literature Reference | D.NICOLETTI,A.A.GHINI,A.L.BRACHET-COTA,G.BURTON J.CHEM.SOC.PERKIN-1,1089(1995) |
| Solvent | Chloroform-d |