| SpectraBase Compound ID | 1eQcrAFvynb |
|---|---|
| InChI | InChI=1S/C47H68O15/c1-24(2)8-15-34(50)25(3)47(55)37(21-33-31-14-11-28-20-29(49)16-18-45(28,5)32(31)17-19-46(33,47)6)60-44-41(59-26(4)48)39(36(52)23-58-44)62-43-40(38(53)35(51)22-57-43)61-42(54)27-9-12-30(56-7)13-10-27/h9-13,24-25,29,31-33,35-41,43-44,49,51-53,55H,8,14-23H2,1-7H3/t25-,29-,31?,32?,33?,35+,36-,37-,38-,39-,40+,41+,43-,44-,45-,46-,47+/m1/s1 |
| InChIKey | MPXTYZZFIJTPPA-WQTHIWJVSA-N |
| Mol Weight | 873.0 g/mol |
| Molecular Formula | C47H68O15 |
| Exact Mass | 872.455821 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FSCfUJcLjrB |
|---|---|
| Name | 3beta,16beta,17alpha-TRIHYDROXYCHOLEST-5-EN-22-ONE 16-O-(2-O-4-METHOXYBENZOYL-beta-D-XYLOPYRANOSYL)-(1->3)-(2-O-ACETYL-alpha-L-ARABINOPYRANOSIDE) |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C47H68O15 |
| InChI | InChI=1S/C47H68O15/c1-24(2)8-15-34(50)25(3)47(55)37(21-33-31-14-11-28-20-29(49)16-18-45(28,5)32(31)17-19-46(33,47)6)60-44-41(59-26(4)48)39(36(52)23-58-44)62-43-40(38(53)35(51)22-57-43)61-42(54)27-9-12-30(56-7)13-10-27/h9-13,24-25,29,31-33,35-41,43-44,49,51-53,55H,8,14-23H2,1-7H3/t25-,29-,31?,32?,33?,35+,36-,37-,38-,39-,40+,41+,43-,44-,45-,46-,47+/m1/s1 |
| InChIKey | MPXTYZZFIJTPPA-WQTHIWJVSA-N |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |