![TRIGONEOSIDE-IA;26-O-BETA-D-GLUCOPYRANOSYL-(25S)-5-ALPHA-FUROSTANE-2-ALPHA,3-BETA,22-XI,26-TETRAOL-3-O-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPY](/api/spectrum/6YTHhKgrP9t/structure.png?h=300&w=458 "TRIGONEOSIDE-IA;26-O-BETA-D-GLUCOPYRANOSYL-(25S)-5-ALPHA-FUROSTANE-2-ALPHA,3-BETA,22-XI,26-TETRAOL-3-O-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPY")
| SpectraBase Compound ID | Lh99YctWan4 |
|---|---|
| InChI | InChI=1S/C44H74O19/c1-18(15-57-40-37(54)34(51)32(49)28(14-45)61-40)7-10-44(56)19(2)30-27(63-44)12-23-21-6-5-20-11-26(24(46)13-43(20,4)22(21)8-9-42(23,30)3)60-41-38(55)35(52)33(50)29(62-41)17-59-39-36(53)31(48)25(47)16-58-39/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 | TVNGRDSDHVARNR-XEDZZGIFSA-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 | 6YTHhKgrP9t |
|---|---|
| Name | TRIGONEOSIDE-IA;26-O-BETA-D-GLUCOPYRANOSYL-(25S)-5-ALPHA-FUROSTANE-2-ALPHA,3-BETA,22-XI,26-TETRAOL-3-O-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPY |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H74O19 |
| InChI | InChI=1S/C44H74O19/c1-18(15-57-40-37(54)34(51)32(49)28(14-45)61-40)7-10-44(56)19(2)30-27(63-44)12-23-21-6-5-20-11-26(24(46)13-43(20,4)22(21)8-9-42(23,30)3)60-41-38(55)35(52)33(50)29(62-41)17-59-39-36(53)31(48)25(47)16-58-39/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 | TVNGRDSDHVARNR-XEDZZGIFSA-N |
| Literature Reference Author | M.YOSHIKAWA,T.MURAKAMI,H.KOMATSU,N.MURAKAMI,J.YAMAHARA,H.MAT SUDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,45,81(1997) |
| Literature Reference DOI | 10.1248/cpb.45.81 |
| Molecular Weight | 907.060 g/mol |
| Solvent | Unknown |
| Source File Reference | UWVN28706 |