![METHYL-[21R,20-(22)-E]-3-BETA-[(6-DEOXY-ALPHA-L-MANNOPYRANOSYL)-OXY]-14-BETA,21-EPOXY-21-METHOXYCHOLA-4,20-(22)-DIEN-24-OATE](/api/spectrum/HjffsrMmpaG/structure.png?h=300&w=458 "METHYL-[21R,20-(22)-E]-3-BETA-[(6-DEOXY-ALPHA-L-MANNOPYRANOSYL)-OXY]-14-BETA,21-EPOXY-21-METHOXYCHOLA-4,20-(22)-DIEN-24-OATE")
| SpectraBase Compound ID | 8EwjIwfTgbS |
|---|---|
| InChI | InChI=1S/C32H48O9/c1-17-25(34)26(35)27(36)29(39-17)40-19-10-13-30(2)18(16-19)6-8-23-22(30)11-14-31(3)21-12-15-32(23,31)41-28(38-5)20(21)7-9-24(33)37-4/h7,16-17,19,21-23,25-29,34-36H,6,8-15H2,1-5H3/b20-7-/t17-,19-,21+,22?,23+,25-,26+,27+,28+,29+,30-,31+,32?/m0/s1 |
| InChIKey | CPJCXGCQFDVCLV-GOURLMCXSA-N |
| Mol Weight | 576.7 g/mol |
| Molecular Formula | C32H48O9 |
| Exact Mass | 576.329833 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 | HjffsrMmpaG |
|---|---|
| Name | METHYL-[21R,20-(22)-E]-3-BETA-[(6-DEOXY-ALPHA-L-MANNOPYRANOSYL)-OXY]-14-BETA,21-EPOXY-21-METHOXYCHOLA-4,20-(22)-DIEN-24-OATE |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H48O9 |
| InChI | InChI=1S/C32H48O9/c1-17-25(34)26(35)27(36)29(39-17)40-19-10-13-30(2)18(16-19)6-8-23-22(30)11-14-31(3)21-12-15-32(23,31)41-28(38-5)20(21)7-9-24(33)37-4/h7,16-17,19,21-23,25-29,34-36H,6,8-15H2,1-5H3/b20-7-/t17-,19-,21+,22?,23+,25-,26+,27+,28+,29+,30-,31+,32?/m0/s1 |
| InChIKey | CPJCXGCQFDVCLV-GOURLMCXSA-N |
| Literature Reference Author | T.TANASE,N.MURAKAMI,A.NAGATSU,J.SAKAKIBARA |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,2217(1993) |
| Literature Reference DOI | 10.1039/p19930002217 |
| Molecular Weight | 576.728 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU4110 |