![SYMPLOCOSOSIDE_K;3-BETA-O-{[BETA-D-GLUCOPYRANOSYL-(1->2)-]-[ALPHA-L-ARABINOFURANOSYL-(1->4)]-BETA-D-(3-O-ACETYL](/api/spectrum/KG15TEXltfS/structure.png?h=300&w=458 "SYMPLOCOSOSIDE_K;3-BETA-O-{[BETA-D-GLUCOPYRANOSYL-(1->2)-]-[ALPHA-L-ARABINOFURANOSYL-(1->4)]-BETA-D-(3-O-ACETYL")
| SpectraBase Compound ID | HcJr36fkPGF |
|---|---|
| InChI | InChI=1S/C67H98O24/c1-32(2)17-16-18-33(3)27-43(72)87-55-56(91-57(80)35-19-14-13-15-20-35)67(31-70)37(28-62(55,5)6)36-21-22-41-64(9)25-24-42(63(7,8)40(64)23-26-65(41,10)66(36,11)53(78)54(67)79)86-61-52(90-60-48(77)46(75)44(73)38(29-68)84-60)50(83-34(4)71)49(51(89-61)58(81)82-12)88-59-47(76)45(74)39(30-69)85-59/h13-15,17,19-21,27,37-42,44-56,59-61,68-70,73-79H,16,18,22-26,28-31H2,1-12H3/b33-27+ |
| InChIKey | LWFZKYRCCSIIFX-MUGXBBEHSA-N |
| Mol Weight | 1287.5 g/mol |
| Molecular Formula | C67H98O24 |
| Exact Mass | 1286.644804 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KG15TEXltfS |
|---|---|
| Name | SYMPLOCOSOSIDE_K;3-BETA-O-{[BETA-D-GLUCOPYRANOSYL-(1->2)-]-[ALPHA-L-ARABINOFURANOSYL-(1->4)]-BETA-D-(3-O-ACETYL |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C67H98O24 |
| InChI | InChI=1S/C67H98O24/c1-32(2)17-16-18-33(3)27-43(72)87-55-56(91-57(80)35-19-14-13-15-20-35)67(31-70)37(28-62(55,5)6)36-21-22-41-64(9)25-24-42(63(7,8)40(64)23-26-65(41,10)66(36,11)53(78)54(67)79)86-61-52(90-60-48(77)46(75)44(73)38(29-68)84-60)50(83-34(4)71)49(51(89-61)58(81)82-12)88-59-47(76)45(74)39(30-69)85-59/h13-15,17,19-21,27,37-42,44-56,59-61,68-70,73-79H,16,18,22-26,28-31H2,1-12H3/b33-27+ |
| InChIKey | LWFZKYRCCSIIFX-MUGXBBEHSA-N |
| Literature Reference Author | G.M.FU,Y.H.WANG,S.GAO,M.J.TANG,S.S.YU |
| Literature Reference Citation | PLANTA.MED.,71,666(2005) |
| Literature Reference DOI | 10.1055/s-2005-871274 |
| Molecular Weight | 1287.501 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ47022 |