| SpectraBase Compound ID | EVKIbxeD06P |
|---|---|
| InChI | InChI=1S/C44H74O19/c1-18(16-57-39-36(54)33(51)32(50)28(14-45)60-39)7-10-44(56)19(2)30-27(63-44)12-23-21-6-5-20-11-26(24(47)13-43(20,4)22(21)8-9-42(23,30)3)59-41-37(55)34(52)38(29(15-46)61-41)62-40-35(53)31(49)25(48)17-58-40/h18-41,45-56H,5-17H2,1-4H3/t18-,19-,20-,21+,22-,23-,24+,25+,26+,27-,28-,29-,30-,31-,32-,33+,34-,35+,36-,37-,38-,39-,40-,41-,42-,43-,44?/m0/s1 |
| InChIKey | CQMKGWHJFNHDAO-DKTUDJKJSA-N |
| Mol Weight | 907.1 g/mol |
| Molecular Formula | C44H74O19 |
| Exact Mass | 906.48243 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FvskK99Mvtr |
|---|---|
| Name | TRIGONEOSIDE-XIB;#3;26-O-BETA-D-GLUCOPYRANOSYL-(25R)-5-ALPHA-FUROSTANE-2-ALPHA,3-BETA,22-XI,26-TETRAOL-3-O-BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H74O19 |
| InChI | InChI=1S/C44H74O19/c1-18(16-57-39-36(54)33(51)32(50)28(14-45)60-39)7-10-44(56)19(2)30-27(63-44)12-23-21-6-5-20-11-26(24(47)13-43(20,4)22(21)8-9-42(23,30)3)59-41-37(55)34(52)38(29(15-46)61-41)62-40-35(53)31(49)25(48)17-58-40/h18-41,45-56H,5-17H2,1-4H3/t18-,19-,20-,21+,22-,23-,24+,25+,26+,27-,28-,29-,30-,31-,32-,33+,34-,35+,36-,37-,38-,39-,40-,41-,42-,43-,44?/m0/s1 |
| InChIKey | CQMKGWHJFNHDAO-DKTUDJKJSA-N |
| Literature Reference Author | T.MURAKAMI,A.KISHI,H.MATSUDA,M.YOSHIKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,48,994(2000) |
| Literature Reference DOI | 10.1248/cpb.48.994 |
| Molecular Weight | 907.060 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN4340 |