| SpectraBase Compound ID | 3xblkKJLvAo |
|---|---|
| InChI | InChI=1S/C25H36O7/c1-14(26)32-20-11-17-18(23(3)7-4-16(27)12-25(20,23)30)5-8-22(2)19(17)6-9-24(22,29)15-10-21(28)31-13-15/h10,16-20,27,29-30H,4-9,11-13H2,1-3H3/t16-,17+,18-,19-,20-,22-,23+,24-,25-/m0/s1 |
| InChIKey | AICIDYVCLPNBHD-MSYSNYFOSA-N |
| Mol Weight | 448.6 g/mol |
| Molecular Formula | C25H36O7 |
| Exact Mass | 448.246103 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1JuRpgVnClU |
|---|---|
| Name | 17-BETA-(2',5'-DIHYDRO-5'-OXO-3'-FURYL)-5-ALPHA-ANDROSTAN-3-BETA,5,6-ALPHA,17-TETROL-6-ACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H36O7 |
| InChI | InChI=1S/C25H36O7/c1-14(26)32-20-11-17-18(23(3)7-4-16(27)12-25(20,23)30)5-8-22(2)19(17)6-9-24(22,29)15-10-21(28)31-13-15/h10,16-20,27,29-30H,4-9,11-13H2,1-3H3/t16-,17+,18-,19-,20-,22-,23+,24-,25-/m0/s1 |
| InChIKey | AICIDYVCLPNBHD-MSYSNYFOSA-N |
| Literature Reference Author | J.W.BLUNT,J.B.STOTHERS |
| Literature Reference Citation | ORG.MAGN.RES.,9,439(1977) |
| Literature Reference DOI | 10.1002/mrc.1270090802 |
| Molecular Weight | 448.557 g/mol |
| Solvent | PYRIDINE |
| Source File Reference | UNIW3998 |