| SpectraBase Compound ID | FpOxesEQD3X |
|---|---|
| InChI | InChI=1S/C39H62O13/c1-19(2)7-10-27(42)20(3)39(47)30(16-26-24-9-8-22-15-23(41)11-13-37(22,5)25(24)12-14-38(26,39)6)51-36-34(50-21(4)40)33(29(44)18-49-36)52-35-32(46)31(45)28(43)17-48-35/h8,19-20,23-26,28-36,41,43-47H,7,9-18H2,1-6H3/t20-,23-,24+,25-,26-,28+,29-,30-,31-,32+,33-,34+,35-,36-,37-,38-,39+/m0/s1 |
| InChIKey | TYVXGSWWXXDXOL-ZMZWECNRSA-N |
| Mol Weight | 738.9 g/mol |
| Molecular Formula | C39H62O13 |
| Exact Mass | 738.419042 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 31Cegtfqe43 |
|---|---|
| Name | 3-BETA,16-BETA,17-ALPHA-TRIHYDROXYCHOLEST-5-EN-22-ONE-16-O-BETA-D-XYLOPYRANOSYL-(1->3)-(2-O-ACETYL-ALPHA-L-ARABINOPYRANOSIDE) |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H62O13 |
| InChI | InChI=1S/C39H62O13/c1-19(2)7-10-27(42)20(3)39(47)30(16-26-24-9-8-22-15-23(41)11-13-37(22,5)25(24)12-14-38(26,39)6)51-36-34(50-21(4)40)33(29(44)18-49-36)52-35-32(46)31(45)28(43)17-48-35/h8,19-20,23-26,28-36,41,43-47H,7,9-18H2,1-6H3/t20-,23-,24+,25-,26-,28+,29-,30-,31-,32+,33-,34+,35-,36-,37-,38-,39+/m0/s1 |
| InChIKey | TYVXGSWWXXDXOL-ZMZWECNRSA-N |
| Literature Reference Author | S.KUBO,Y.MIMAKI,M.TERAO,Y.SASHIDA,T.NIKAIDO,T.OHMOTO |
| Literature Reference Citation | PHYTOCHEM.,31,3969(1992) |
| Literature Reference DOI | 10.1016/S0031-9422(00)97565-4 |
| Molecular Weight | 738.913 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU28857 |