| SpectraBase Compound ID | 3uc30krBmIi |
|---|---|
| InChI | InChI=1S/C37H54O5/c1-8-24(21(2)3)19-31(39)22(4)28-13-14-29-27-20-32(40)34-23(5)33(42-35(41)25-9-11-26(38)12-10-25)16-18-37(34,7)30(27)15-17-36(28,29)6/h9-12,20-24,28-31,33-34,38-39H,8,13-19H2,1-7H3/t22-,23+,24+,28+,29-,30-,31?,33-,34+,36+,37+/m0/s1 |
| InChIKey | ZWTFLEDANUBHKP-KAUKFWHQSA-N |
| Mol Weight | 578.8 g/mol |
| Molecular Formula | C37H54O5 |
| Exact Mass | 578.397125 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | IYldhxDwQaO |
|---|---|
| Name | 3-BETA-(PARA-HYDROXY-BENZOYL)-OXY-22-ALPHA-HYDROXY-4-ALPHA-METHYL-5-ALPHA-STIGMAST-7-EN-6-ONE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H54O5 |
| InChI | InChI=1S/C37H54O5/c1-8-24(21(2)3)19-31(39)22(4)28-13-14-29-27-20-32(40)34-23(5)33(42-35(41)25-9-11-26(38)12-10-25)16-18-37(34,7)30(27)15-17-36(28,29)6/h9-12,20-24,28-31,33-34,38-39H,8,13-19H2,1-7H3/t22-,23+,24+,28+,29-,30-,31?,33-,34+,36+,37+/m0/s1 |
| InChIKey | ZWTFLEDANUBHKP-KAUKFWHQSA-N |
| Literature Reference Author | K.H.GAN,C.N.LIN,S.J.WON |
| Literature Reference Citation | J.NAT.PROD.,56,15(1993) |
| Literature Reference DOI | 10.1021/np50091a003 |
| Molecular Weight | 578.833 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWTS902 |