| SpectraBase Compound ID | AzBCQARZGCE |
|---|---|
| InChI | InChI=1S/C29H48O5/c1-17(2)8-7-9-18(3)21-10-11-22-24-23(13-14-27(21,22)5)28(6)15-12-20(34-19(4)30)16-29(28,33)25(24)26(31)32/h17-18,20-25,33H,7-16H2,1-6H3,(H,31,32)/t18-,20+,21-,22+,23+,24+,25+,27-,28-,29-/m1/s1 |
| InChIKey | QDQAXWJFDPGAOB-MWLOYGDUSA-N |
| Mol Weight | 476.7 g/mol |
| Molecular Formula | C29H48O5 |
| Exact Mass | 476.350175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ExuvMTBzOQ0 |
|---|---|
| Name | B-NOR-3-BETA-ACETOXY-5-BETA-HYDROXY-CHOLESTAN-6-BETA-CARBOXYLIC-ACID |
| Compound Number | 35 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H48O5 |
| InChI | InChI=1S/C29H48O5/c1-17(2)8-7-9-18(3)21-10-11-22-24-23(13-14-27(21,22)5)28(6)15-12-20(34-19(4)30)16-29(28,33)25(24)26(31)32/h17-18,20-25,33H,7-16H2,1-6H3,(H,31,32)/t18-,20+,21-,22+,23+,24+,25+,27-,28-,29-/m1/s1 |
| InChIKey | QDQAXWJFDPGAOB-MWLOYGDUSA-N |
| Literature Reference Author | V.DAVE,J.B.STOTHERS |
| Literature Reference Citation | CAN.J.CHEM.,57,1550(1979) |
| Literature Reference DOI | 10.1139/v79-253 |
| Molecular Weight | 476.697 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED1613 |