![#4;(22R*,24R*,25S*)-3-BETA-[(O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSYL)-OXY]-22-HYDR](/api/spectrum/4PBxvXHeLKM/structure.png?h=300&w=458 "#4;(22R*,24R*,25S*)-3-BETA-[(O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSYL)-OXY]-22-HYDR")
| SpectraBase Compound ID | 2j2pD9PEsvH |
|---|---|
| InChI | InChI=1S/C52H84O23/c1-20-14-29(69-46(66)21(20)2)22(3)26-8-9-27-25-7-6-23-15-24(10-12-51(23,4)28(25)11-13-52(26,27)5)68-50-45(39(61)36(58)33(73-50)19-67-47-41(63)37(59)34(56)30(16-53)70-47)75-49-43(65)40(62)44(32(18-55)72-49)74-48-42(64)38(60)35(57)31(17-54)71-48/h6,20-22,24-45,47-50,53-65H,7-19H2,1-5H3/t20-,21+,22+,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34-,35+,36-,37+,38-,39+,40-,41-,42+,43-,44-,45-,47-,48-,49+,50-,51+,52-/m1/s1 |
| InChIKey | JILPKRCJPRKBEL-ZTHHYNNRSA-N |
| Mol Weight | 1077.2 g/mol |
| Molecular Formula | C52H84O23 |
| Exact Mass | 1076.540339 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4PBxvXHeLKM |
|---|---|
| Name | #4;(22R*,24R*,25S*)-3-BETA-[(O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-[BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSYL)-OXY]-22-HYDR |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H84O23 |
| InChI | InChI=1S/C52H84O23/c1-20-14-29(69-46(66)21(20)2)22(3)26-8-9-27-25-7-6-23-15-24(10-12-51(23,4)28(25)11-13-52(26,27)5)68-50-45(39(61)36(58)33(73-50)19-67-47-41(63)37(59)34(56)30(16-53)70-47)75-49-43(65)40(62)44(32(18-55)72-49)74-48-42(64)38(60)35(57)31(17-54)71-48/h6,20-22,24-45,47-50,53-65H,7-19H2,1-5H3/t20-,21+,22+,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34-,35+,36-,37+,38-,39+,40-,41-,42+,43-,44-,45-,47-,48-,49+,50-,51+,52-/m1/s1 |
| InChIKey | JILPKRCJPRKBEL-ZTHHYNNRSA-N |
| Literature Reference Author | A.YOKOSUKA,Y.MIMAKI |
| Literature Reference Citation | CHEM.PHARM.BULL.,55,273(2007) |
| Literature Reference DOI | 10.1248/cpb.55.273 |
| Molecular Weight | 1077.225 g/mol |
| Sample ID | 55429 |
| Solvent | C5D5N |