| SpectraBase Compound ID | 2sdDZgIrxRB |
|---|---|
| InChI | InChI=1S/C29H44O4/c1-17(4-5-18-14-20(30)6-9-25(18)32)22-7-8-23-27-24(11-13-29(22,23)3)28(2)12-10-21(31)15-19(28)16-26(27)33/h6,9,14,17,19,21-24,26-27,30-33H,4-5,7-8,10-13,15-16H2,1-3H3/t17-,19+,21-,22-,23+,24+,26-,27+,28+,29-/m1/s1 |
| InChIKey | LYTAFSOZOZGBFJ-ONPQFZDASA-N |
| Mol Weight | 456.7 g/mol |
| Molecular Formula | C29H44O4 |
| Exact Mass | 456.32396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 50C3Iy5ZFtx |
|---|---|
| Name | 23-HYDROQUINOYL-3-ALPHA,7-ALPHA-DIHYDROXY-24-NOR-5-BETA-CHOLANE |
| Compound Number | 7A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H44O4 |
| InChI | InChI=1S/C29H44O4/c1-17(4-5-18-14-20(30)6-9-25(18)32)22-7-8-23-27-24(11-13-29(22,23)3)28(2)12-10-21(31)15-19(28)16-26(27)33/h6,9,14,17,19,21-24,26-27,30-33H,4-5,7-8,10-13,15-16H2,1-3H3/t17-,19+,21-,22-,23+,24+,26-,27+,28+,29-/m1/s1 |
| InChIKey | LYTAFSOZOZGBFJ-ONPQFZDASA-N |
| Literature Reference Author | G.E.SILESS,M.E.KNOTT,M.G.DERITA,S.A.ZACCHINO,L.PURICELLI,J.A .PALERMO |
| Literature Reference Citation | STEROIDS,77,45(2012) |
| Literature Reference DOI | 10.1016/j.steroids.2011.09.012 |
| Molecular Weight | 456.666 g/mol |
| Sample ID | 70527 |
| Solvent | CD3OD |