| SpectraBase Compound ID | 8bxB4fszz94 |
|---|---|
| InChI | InChI=1S/C27H44O3/c1-18-9-10-21(28)16-20(18)17-24-27(30-24)15-7-14-26(5)22(11-12-23(26)27)19(2)8-6-13-25(3,4)29/h17,19,21-24,28-29H,1,6-16H2,2-5H3/b20-17-/t19-,21+,22-,23?,24-,26-,27-/m1/s1 |
| InChIKey | UOQNHTGEVYSRKO-VJSHZGRKSA-N |
| Mol Weight | 416.6 g/mol |
| Molecular Formula | C27H44O3 |
| Exact Mass | 416.329045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8CoWjkvYZXJ |
|---|---|
| Name | 7R-EPOXY-25-HYDROXY-9,10-SECO-5,7,9(10)-CHOLESTRIEN-OL;(VITAMIN-D-DERIVATIVE) |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O3 |
| InChI | InChI=1S/C27H44O3/c1-18-9-10-21(28)16-20(18)17-24-27(30-24)15-7-14-26(5)22(11-12-23(26)27)19(2)8-6-13-25(3,4)29/h17,19,21-24,28-29H,1,6-16H2,2-5H3/b20-17-/t19-,21+,22-,23?,24-,26-,27-/m1/s1 |
| InChIKey | UOQNHTGEVYSRKO-VJSHZGRKSA-N |
| Literature Reference Author | W.REISCHL |
| Literature Reference Citation | MH.CHEM.,120,1185(1989) |
| Literature Reference DOI | 10.1007/BF00809302 |
| Molecular Weight | 416.645 g/mol |
| Solvent | Unknown |
| Source File Reference | UWWR5027 |