| SpectraBase Compound ID | F7ApEOqwJ8t |
|---|---|
| InChI | InChI=1S/C30H52O3/c1-25(2)21-12-17-29(7)22(27(21,5)15-13-23(25)31)10-9-19-20(11-16-28(19,29)6)30(8)18-14-24(33-30)26(3,4)32/h19-24,31-32H,9-18H2,1-8H3/t19-,20-,21+,22-,23-,24-,27+,28-,29-,30-/m1/s1 |
| InChIKey | RQBNSDSKUAGBOI-VCYFINDISA-N |
| Mol Weight | 460.7 g/mol |
| Molecular Formula | C30H52O3 |
| Exact Mass | 460.391646 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CHnha75V2hN |
|---|---|
| Name | CABRALEADIOL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H52O3 |
| InChI | InChI=1S/C30H52O3/c1-25(2)21-12-17-29(7)22(27(21,5)15-13-23(25)31)10-9-19-20(11-16-28(19,29)6)30(8)18-14-24(33-30)26(3,4)32/h19-24,31-32H,9-18H2,1-8H3/t19-,20-,21+,22-,23-,24-,27+,28-,29-,30-/m1/s1 |
| InChIKey | RQBNSDSKUAGBOI-VCYFINDISA-N |
| Literature Reference Author | P.H.J.BATISTA,J.R.M.D.ANDRADE,T.S.MATOS,T.D.S.SOUSA,F.D.C.L. PINTO,E.R.SILVEIRA |
| Literature Reference Citation | QUIM.NOVA,37,1010(2014) |
| Molecular Weight | 460.741 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR11962 |