| SpectraBase Compound ID | 8uFL3jdIIEt |
|---|---|
| InChI | InChI=1S/C29H42O3/c1-18(20(3)27(31)32-6)7-8-19(2)24-11-12-25-23-10-9-21-17-22(30)13-15-28(21,4)26(23)14-16-29(24,25)5/h7-8,13,15,17-20,23-26H,9-12,14,16H2,1-6H3/b8-7+/t18-,19+,20?,23-,24+,25-,26-,28?,29?/m0/s1 |
| InChIKey | MVINIBXXKDAJCX-AMEBDMKRSA-N |
| Mol Weight | 438.7 g/mol |
| Molecular Formula | C29H42O3 |
| Exact Mass | 438.313395 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 | FM9dMVVb8RW |
|---|---|
| Name | 3-OXO-1,4,22-ERGOSTA-TRIEN-26-OIC-ACID-METHYLESTER |
| Compound Number | III |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H42O3 |
| InChI | InChI=1S/C29H42O3/c1-18(20(3)27(31)32-6)7-8-19(2)24-11-12-25-23-10-9-21-17-22(30)13-15-28(21,4)26(23)14-16-29(24,25)5/h7-8,13,15,17-20,23-26H,9-12,14,16H2,1-6H3/b8-7+/t18-,19+,20?,23-,24+,25-,26-,28?,29?/m0/s1 |
| InChIKey | MVINIBXXKDAJCX-AMEBDMKRSA-N |
| Literature Reference Author | G.AMBRUS,E.ILKOY,A.JEKKEL,G.HORVATH,Z.BOECSKEI |
| Literature Reference Citation | STEROIDS,60,626(1995) |
| Literature Reference DOI | 10.1016/0039-128x(95)00078-5 |
| Molecular Weight | 438.651 g/mol |
| Source File Reference | UWLU73852 |