| SpectraBase Compound ID | HVb6GzRve4P |
|---|---|
| InChI | InChI=1S/C29H46O3/c1-19(6-7-20(14-17-30)27(2,3)32)24-10-11-25-23-9-8-21-18-22(31)12-15-28(21,4)26(23)13-16-29(24,25)5/h11,14,19,21-22,24,30-32H,6-10,12-13,15-18H2,1-5H3/b20-14-/t19-,21?,22+,24-,28+,29-/m1/s1 |
| InChIKey | WPRMCEIOQJVUEH-ARASPXCASA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C29H46O3 |
| Exact Mass | 442.344695 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GFWQTEMYmdM |
|---|---|
| Name | 3-BETA,25,29-TRIHYDROXY-5-ALPHA-STIGMASTA-8(9),14(15),24Z(28)-TRIENE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H46O3 |
| InChI | InChI=1S/C29H46O3/c1-19(6-7-20(14-17-30)27(2,3)32)24-10-11-25-23-9-8-21-18-22(31)12-15-28(21,4)26(23)13-16-29(24,25)5/h11,14,19,21-22,24,30-32H,6-10,12-13,15-18H2,1-5H3/b20-14-/t19-,21?,22+,24-,28+,29-/m1/s1 |
| InChIKey | WPRMCEIOQJVUEH-ARASPXCASA-N |
| Literature Reference Author | G.CIOFFI,R.SANOGO,D.DIALLO,G.ROMUSSI,N.D.TOMMASI |
| Literature Reference Citation | J.NAT.PROD.,67,389(2004) |
| Literature Reference DOI | 10.1021/np030337p |
| Molecular Weight | 442.682 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWKP4229 |