| SpectraBase Compound ID | JvvsRerbueE |
|---|---|
| InChI | InChI=1S/C29H46O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,20-21,23-27,30H,2,7,11-18H2,1,3-6H3/b9-8+/t20-,21-,23+,24+,25-,26+,27+,28?,29-/m1/s1 |
| InChIKey | ZTJFINKUHDHOSM-CQTWCWTKSA-N |
| Mol Weight | 410.7 g/mol |
| Molecular Formula | C29H46O |
| Exact Mass | 410.354866 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | nqHxlakgqh |
|---|---|
| Name | 22-DEHYDROCLEROSTEROL;(24-BETA)-STIGMASTA-5,22,25-TRIENOL |
| Compound Number | 2H |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H46O |
| InChI | InChI=1S/C29H46O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,20-21,23-27,30H,2,7,11-18H2,1,3-6H3/b9-8+/t20-,21-,23+,24+,25-,26+,27+,28?,29-/m1/s1 |
| InChIKey | ZTJFINKUHDHOSM-CQTWCWTKSA-N |
| Literature Reference Author | S.G.LEITAO,M.A.C.KAPLAN,F.D.MONACHE,T.AKIHISA,T.TAMURA |
| Literature Reference Citation | PHYTOCHEM.,31,2813(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)83637-E |
| Molecular Weight | 410.684 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ23286 |