![TRIGONEOSIDE-IIA;26-O-BETA-D-GLUCOPYRANOSYL-(25S)-5-BETA-FUROSTANE-3-BETA,22-XI,26-TRIOL-3-O-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/I9FyhfGojcW/structure.png?h=300&w=458 "TRIGONEOSIDE-IIA;26-O-BETA-D-GLUCOPYRANOSYL-(25S)-5-BETA-FUROSTANE-3-BETA,22-XI,26-TRIOL-3-O-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | FoWQUOLZbFq |
|---|---|
| InChI | InChI=1S/C44H74O18/c1-19(16-56-40-37(53)34(50)32(48)28(15-45)60-40)7-12-44(55)20(2)30-27(62-44)14-25-23-6-5-21-13-22(8-10-42(21,3)24(23)9-11-43(25,30)4)59-41-38(54)35(51)33(49)29(61-41)18-58-39-36(52)31(47)26(46)17-57-39/h19-41,45-55H,5-18H2,1-4H3/t19-,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 | ISFAETRPBLFKQD-GTAMXFRCSA-N |
| Mol Weight | 891.1 g/mol |
| Molecular Formula | C44H74O18 |
| Exact Mass | 890.487516 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I9FyhfGojcW |
|---|---|
| Name | TRIGONEOSIDE-IIA;26-O-BETA-D-GLUCOPYRANOSYL-(25S)-5-BETA-FUROSTANE-3-BETA,22-XI,26-TRIOL-3-O-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H74O18 |
| InChI | InChI=1S/C44H74O18/c1-19(16-56-40-37(53)34(50)32(48)28(15-45)60-40)7-12-44(55)20(2)30-27(62-44)14-25-23-6-5-21-13-22(8-10-42(21,3)24(23)9-11-43(25,30)4)59-41-38(54)35(51)33(49)29(61-41)18-58-39-36(52)31(47)26(46)17-57-39/h19-41,45-55H,5-18H2,1-4H3/t19-,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 | ISFAETRPBLFKQD-GTAMXFRCSA-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 | 891.061 g/mol |
| Solvent | Unknown |
| Source File Reference | UWVN28708 |