![JUNCOSIDE-III;#3;3-BETA-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-22S-HYDROXYCYCLOART-24E-EN-26-OIC-ACID-26-O-6-ALPHA](/api/spectrum/2kllfCu5Jde/structure.png?h=300&w=458 "JUNCOSIDE-III;#3;3-BETA-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-22S-HYDROXYCYCLOART-24E-EN-26-OIC-ACID-26-O-6-ALPHA")
| SpectraBase Compound ID | KoT9Dfj1PvE |
|---|---|
| InChI | InChI=1S/C54H88O24/c1-22(45(69)71-20-29-36(62)37(63)41(67)46(70)72-29)7-8-25(58)23(2)24-11-13-52(6)31-10-9-30-50(3,4)32(12-14-53(30)21-54(31,53)16-15-51(24,52)5)76-48-43(39(65)34(60)27(18-56)74-48)78-49-44(40(66)35(61)28(19-57)75-49)77-47-42(68)38(64)33(59)26(17-55)73-47/h7,23-44,46-49,55-68,70H,8-21H2,1-6H3/b22-7+/t23-,24+,25-,26+,27+,28+,29+,30-,31-,32-,33+,34+,35+,36+,37-,38-,39-,40-,41+,42+,43+,44+,46-,47-,48-,49-,51+,52-,53+,54-/m0/s1 |
| InChIKey | HDLBKMRJZQLWKP-UFIGBURNSA-N |
| Mol Weight | 1121.3 g/mol |
| Molecular Formula | C54H88O24 |
| Exact Mass | 1120.566554 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2kllfCu5Jde |
|---|---|
| Name | JUNCOSIDE-III;#3;3-BETA-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-22S-HYDROXYCYCLOART-24E-EN-26-OIC-ACID-26-O-6-ALPHA |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H88O24 |
| InChI | InChI=1S/C54H88O24/c1-22(45(69)71-20-29-36(62)37(63)41(67)46(70)72-29)7-8-25(58)23(2)24-11-13-52(6)31-10-9-30-50(3,4)32(12-14-53(30)21-54(31,53)16-15-51(24,52)5)76-48-43(39(65)34(60)27(18-56)74-48)78-49-44(40(66)35(61)28(19-57)75-49)77-47-42(68)38(64)33(59)26(17-55)73-47/h7,23-44,46-49,55-68,70H,8-21H2,1-6H3/b22-7+/t23-,24+,25-,26+,27+,28+,29+,30-,31-,32-,33+,34+,35+,36+,37-,38-,39-,40-,41+,42+,43+,44+,46-,47-,48-,49-,51+,52-,53+,54-/m0/s1 |
| InChIKey | HDLBKMRJZQLWKP-UFIGBURNSA-N |
| Literature Reference Author | M.M.CORSARO,M.D.GRECA,A.FIORENTINO,P.MONACO,L.PREVITERA |
| Literature Reference Citation | PHYTOCHEM.,37,515(1994) |
| Literature Reference DOI | 10.1016/0031-9422(94)85090-9 |
| Molecular Weight | 1121.278 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS22983 |