| SpectraBase Compound ID | 3SNJSDebWM9 |
|---|---|
| InChI | InChI=1S/C52H84O21/c1-22-11-16-52(46(64)73-45-40(72-44-39(63)35(59)31(55)23(2)69-44)36(60)34(58)27(70-45)21-68-42-37(61)32(56)25(53)19-66-42)18-17-49(6)24(41(52)51(22,8)65)9-10-29-48(5)14-13-30(47(3,4)28(48)12-15-50(29,49)7)71-43-38(62)33(57)26(54)20-67-43/h9,22-23,25-45,53-63,65H,10-21H2,1-8H3/t22-,23+,25-,26+,27-,28+,29-,30+,31+,32+,33+,34-,35-,36+,37-,38-,39-,40-,41-,42+,43+,44+,45+,48?,49?,50?,51-,52+/m1/s1 |
| InChIKey | MKVWFPGHWAHUHX-QEXNPCSVSA-N |
| Mol Weight | 1045.2 g/mol |
| Molecular Formula | C52H84O21 |
| Exact Mass | 1044.55051 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GqqHykGBeQg |
|---|---|
| Name | ILEXOSIDE-V;3-O-ALPHA-L-ARABINOPYRANOSYL-POMOLIC-ACID-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H84O21 |
| InChI | InChI=1S/C52H84O21/c1-22-11-16-52(46(64)73-45-40(72-44-39(63)35(59)31(55)23(2)69-44)36(60)34(58)27(70-45)21-68-42-37(61)32(56)25(53)19-66-42)18-17-49(6)24(41(52)51(22,8)65)9-10-29-48(5)14-13-30(47(3,4)28(48)12-15-50(29,49)7)71-43-38(62)33(57)26(54)20-67-43/h9,22-23,25-45,53-63,65H,10-21H2,1-8H3/t22-,23+,25-,26+,27-,28+,29-,30+,31+,32+,33+,34-,35-,36+,37-,38-,39-,40-,41-,42+,43+,44+,45+,48?,49?,50?,51-,52+/m1/s1 |
| InChIKey | MKVWFPGHWAHUHX-QEXNPCSVSA-N |
| Literature Reference Author | T.KAKUNO,K.YSHIKAWA,S.ARIHARA |
| Literature Reference Citation | PHYTOCHEM.,31,3553(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)83726-F |
| Molecular Weight | 1045.226 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS27136 |