![#3;MASONOSIDE-C;3-O-[ALPHA-L-ARABINOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL]-28-O-[2-O-[BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL]-3-O-(BETA-D-GLUCOPY](/api/spectrum/Dzlsj8ErXSZ/structure.png?h=300&w=458 "#3;MASONOSIDE-C;3-O-[ALPHA-L-ARABINOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL]-28-O-[2-O-[BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL]-3-O-(BETA-D-GLUCOPY")
| SpectraBase Compound ID | 1NhaSJJcgMJ |
|---|---|
| InChI | InChI=1S/C80H132O36/c1-36-62(112-69-58(98)51(91)44(88)33-105-69)56(96)61(101)70(107-36)114-65-64(113-71-59(99)54(94)52(92)45(31-82)109-71)63(111-67(102)41(85)20-16-12-11-15-19-38(84)18-14-10-9-13-17-27-81)37(2)108-73(65)116-74(103)80-26-25-75(3,4)28-40(80)39-21-22-48-76(5)29-42(86)66(77(6,35-83)47(76)23-24-78(48,7)79(39,8)30-49(80)89)115-72-60(100)55(95)53(93)46(110-72)34-106-68-57(97)50(90)43(87)32-104-68/h21,36-37,40-66,68-73,81-83,85-101H,9-20,22-35H2,1-8H3/t36-,37+,40-,41?,42-,43-,44-,45-,46+,47+,48+,49+,50-,51+,52-,53+,54+,55-,56-,57+,58-,59-,60+,61+,62-,63-,64-,65+,66-,68-,69+,70-,71+,72-,73-,76-,77-,78+,79+,80+/m0/s1 |
| InChIKey | AIMQBMNKFQLRNA-XRHVHILLSA-N |
| Mol Weight | 1669.9 g/mol |
| Molecular Formula | C80H132O36 |
| Exact Mass | 1668.849831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dzlsj8ErXSZ |
|---|---|
| Name | #3;MASONOSIDE-C;3-O-[ALPHA-L-ARABINOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL]-28-O-[2-O-[BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL]-3-O-(BETA-D-GLUCOPY |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C80H132O36 |
| InChI | InChI=1S/C80H132O36/c1-36-62(112-69-58(98)51(91)44(88)33-105-69)56(96)61(101)70(107-36)114-65-64(113-71-59(99)54(94)52(92)45(31-82)109-71)63(111-67(102)41(85)20-16-12-11-15-19-38(84)18-14-10-9-13-17-27-81)37(2)108-73(65)116-74(103)80-26-25-75(3,4)28-40(80)39-21-22-48-76(5)29-42(86)66(77(6,35-83)47(76)23-24-78(48,7)79(39,8)30-49(80)89)115-72-60(100)55(95)53(93)46(110-72)34-106-68-57(97)50(90)43(87)32-104-68/h21,36-37,40-66,68-73,81-83,85-101H,9-20,22-35H2,1-8H3/t36-,37+,40-,41?,42-,43-,44-,45-,46+,47+,48+,49+,50-,51+,52-,53+,54+,55-,56-,57+,58-,59-,60+,61+,62-,63-,64-,65+,66-,68-,69+,70-,71+,72-,73-,76-,77-,78+,79+,80+/m0/s1 |
| InChIKey | AIMQBMNKFQLRNA-XRHVHILLSA-N |
| Literature Reference Author | Y.ASADA,M.IKENO,T.FURUYA |
| Literature Reference Citation | PHYTOCHEM.,35,757(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90600-9 |
| Molecular Weight | 1669.906 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU25126 |