![#1;DESACYL-MASONOSIDE-4;3-O-[BETA-D-FUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL]-28-O-[2-O-[BETA-D-APIOFURANOSYL-(1->4)-BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAM](/api/spectrum/AZO2Ib3TQJZ/structure.png?h=300&w=458 "#1;DESACYL-MASONOSIDE-4;3-O-[BETA-D-FUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL]-28-O-[2-O-[BETA-D-APIOFURANOSYL-(1->4)-BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAM")
| SpectraBase Compound ID | ESFu7I5K2lR |
|---|---|
| InChI | InChI=1S/C70H114O36/c1-25-37(76)42(81)47(86)56(96-25)93-20-32-40(79)44(83)49(88)60(100-32)105-55-30(74)17-65(6)34(66(55,7)22-72)12-13-67(8)35(65)11-10-28-29-16-64(4,5)14-15-70(29,36(75)18-68(28,67)9)63(91)106-61-53(52(38(77)26(2)97-61)103-59-48(87)43(82)39(78)31(19-71)99-59)104-58-50(89)45(84)51(27(3)98-58)102-57-46(85)41(80)33(21-94-57)101-62-54(90)69(92,23-73)24-95-62/h10,25-27,29-62,71-90,92H,11-24H2,1-9H3/t25-,26-,27+,29+,30+,31+,32-,33+,34-,35-,36-,37+,38+,39+,40-,41-,42+,43-,44+,45+,46+,47-,48+,49-,50-,51+,52+,53-,54-,55+,56-,57-,58+,59-,60+,61+,62-,65+,66+,67-,68-,69+,70-/m1/s1 |
| InChIKey | MQPPKQQFINUGCL-KSFBUUQQSA-N |
| Mol Weight | 1531.6 g/mol |
| Molecular Formula | C70H114O36 |
| Exact Mass | 1530.70898 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AZO2Ib3TQJZ |
|---|---|
| Name | #1;DESACYL-MASONOSIDE-4;3-O-[BETA-D-FUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL]-28-O-[2-O-[BETA-D-APIOFURANOSYL-(1->4)-BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAM |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C70H114O36 |
| InChI | InChI=1S/C70H114O36/c1-25-37(76)42(81)47(86)56(96-25)93-20-32-40(79)44(83)49(88)60(100-32)105-55-30(74)17-65(6)34(66(55,7)22-72)12-13-67(8)35(65)11-10-28-29-16-64(4,5)14-15-70(29,36(75)18-68(28,67)9)63(91)106-61-53(52(38(77)26(2)97-61)103-59-48(87)43(82)39(78)31(19-71)99-59)104-58-50(89)45(84)51(27(3)98-58)102-57-46(85)41(80)33(21-94-57)101-62-54(90)69(92,23-73)24-95-62/h10,25-27,29-62,71-90,92H,11-24H2,1-9H3/t25-,26-,27+,29+,30+,31+,32-,33+,34-,35-,36-,37+,38+,39+,40-,41-,42+,43-,44+,45+,46+,47-,48+,49-,50-,51+,52+,53-,54-,55+,56-,57-,58+,59-,60+,61+,62-,65+,66+,67-,68-,69+,70-/m1/s1 |
| InChIKey | MQPPKQQFINUGCL-KSFBUUQQSA-N |
| Literature Reference Author | Y.ASADA,M.IKENO,T.FURUYA |
| Literature Reference Citation | PHYTOCHEM.,36,455(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)97094-8 |
| Molecular Weight | 1531.654 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS25239 |