| SpectraBase Compound ID | I9GFOOkCivm |
|---|---|
| InChI | InChI=1S/C30H48O/c1-8-22(19(2)3)10-9-20(4)24-13-14-26-23-11-12-25-21(5)28(31)16-18-30(25,7)27(23)15-17-29(24,26)6/h11,14,19-20,22,24-25,27-28,31H,5,8-10,12-13,15-18H2,1-4,6-7H3/t20-,22+,24-,25+,27+,28+,29-,30+/m1/s1 |
| InChIKey | RFBJODRPWDQHGR-HFLKTIQXSA-N |
| Mol Weight | 424.7 g/mol |
| Molecular Formula | C30H48O |
| Exact Mass | 424.370516 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LMDfm1LaVIP |
|---|---|
| Name | THEONELLASTEROL-J |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O |
| InChI | InChI=1S/C30H48O/c1-8-22(19(2)3)10-9-20(4)24-13-14-26-23-11-12-25-21(5)28(31)16-18-30(25,7)27(23)15-17-29(24,26)6/h11,14,19-20,22,24-25,27-28,31H,5,8-10,12-13,15-18H2,1-4,6-7H3/t20-,22+,24-,25+,27+,28+,29-,30+/m1/s1 |
| InChIKey | RFBJODRPWDQHGR-HFLKTIQXSA-N |
| Literature Reference Author | S.DEMARINO,R.UMMARINO,M.V.DAURIA,M.G.CHINI,G.BIFULCO,C.DAMOR E,B.RENGA,A.MENCAREL |
| Literature Reference Citation | STEROIDS,77,484(2012) |
| Literature Reference DOI | 10.1016/j.steroids.2012.01.006 |
| Molecular Weight | 424.711 g/mol |
| Sample ID | 70597 |
| Solvent | C6D6 |