| SpectraBase Compound ID | CxArFGTvC2e |
|---|---|
| InChI | InChI=1S/C27H44O5/c1-17(2)7-6-8-18(3)21-9-10-22(25(21,4)13-14-28)20-15-23(30)27(32)16-19(29)11-12-26(27,5)24(20)31/h6,8,15,17-19,21-23,28-30,32H,7,9-14,16H2,1-5H3/b8-6+/t18-,19+,21-,22+,23+,25-,26-,27+/m1/s1 |
| InChIKey | LTTIMTPEEUOKCQ-KJIUYDRXSA-N |
| Mol Weight | 448.6 g/mol |
| Molecular Formula | C27H44O5 |
| Exact Mass | 448.318875 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 | IcEIMfXqIVw |
|---|---|
| Name | 3-BETA,5-ALPHA,6-BETA-TRIHYDROXY-9,11-SECO-CHOLESTA-7,22-DIEN-9-ONE |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O5 |
| InChI | InChI=1S/C27H44O5/c1-17(2)7-6-8-18(3)21-9-10-22(25(21,4)13-14-28)20-15-23(30)27(32)16-19(29)11-12-26(27,5)24(20)31/h6,8,15,17-19,21-23,28-30,32H,7,9-14,16H2,1-5H3/b8-6+/t18-,19+,21-,22+,23+,25-,26-,27+/m1/s1 |
| InChIKey | LTTIMTPEEUOKCQ-KJIUYDRXSA-N |
| Literature Reference Author | A.AIELLO,E.FATTORUSSO,M.MENNA,R.CARNUCCIO,T.IUVONE |
| Literature Reference Citation | STEROIDS,60,666(1995) |
| Literature Reference DOI | 10.1016/0039-128x(95)00055-u |
| Molecular Weight | 448.643 g/mol |
| Source File Reference | UWLU73856 |