![AOS-4-BETA;2-O-(4-O-METHYL-ALPHA-D-GLUCOPYRANOSYLURONIC-ACID)-4-O-[BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-XYLOPYRANOSYL]-BETA-D-XYLOPYR](/api/spectrum/HLeXsyw2t8B/structure.png?h=300&w=458 "AOS-4-BETA;2-O-(4-O-METHYL-ALPHA-D-GLUCOPYRANOSYLURONIC-ACID)-4-O-[BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-XYLOPYRANOSYL]-BETA-D-XYLOPYR")
| SpectraBase Compound ID | 8si0MlPulWo |
|---|---|
| InChI | InChI=1S/C27H44O23/c1-41-19-14(33)18(37)27(50-21(19)22(38)39)49-20-13(32)9(3-42-23(20)40)48-26-17(36)12(31)8(5-45-26)47-25-16(35)11(30)7(4-44-25)46-24-15(34)10(29)6(28)2-43-24/h6-21,23-37,40H,2-5H2,1H3,(H,38,39)/t6-,7-,8-,9-,10+,11+,12+,13+,14+,15-,16-,17-,18+,19-,20-,21-,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey | IFOINLOIRBRROW-PHKSYIFMSA-N |
| Mol Weight | 736.6 g/mol |
| Molecular Formula | C27H44O23 |
| Exact Mass | 736.227338 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HLeXsyw2t8B |
|---|---|
| Name | AOS-4-BETA;2-O-(4-O-METHYL-ALPHA-D-GLUCOPYRANOSYLURONIC-ACID)-4-O-[BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-XYLOPYRANOSYL]-BETA-D-XYLOPYR |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O23 |
| InChI | InChI=1S/C27H44O23/c1-41-19-14(33)18(37)27(50-21(19)22(38)39)49-20-13(32)9(3-42-23(20)40)48-26-17(36)12(31)8(5-45-26)47-25-16(35)11(30)7(4-44-25)46-24-15(34)10(29)6(28)2-43-24/h6-21,23-37,40H,2-5H2,1H3,(H,38,39)/t6-,7-,8-,9-,10+,11+,12+,13+,14+,15-,16-,17-,18+,19-,20-,21-,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey | IFOINLOIRBRROW-PHKSYIFMSA-N |
| Literature Reference Author | J.M.IGARTUBURU,E.PANDO,F.R.LUIS,A.GIL-SERRANO |
| Literature Reference Citation | PHYTOCHEM.,46,1307(1997) |
| Literature Reference DOI | 10.1016/s0031-9422(97)00480-9 |
| Molecular Weight | 736.633 g/mol |
| Sample ID | 45727 |
| Solvent | D2O |