![CLINOPODISIDE-A;#1;3-O-BETA-D-GLUCOPYRANOSYL-(1->6)-[BETA-D-GLUCOPYRANOSYL-(1->4)]-BETA-D-GLUCOPYRANOSYL-OLEAN-11,13(18)-DIENE-3-BETA,16-BETA,23,28-TETROL](/api/spectrum/Dsq6WmoOhJk/structure.png?h=300&w=458 "CLINOPODISIDE-A;#1;3-O-BETA-D-GLUCOPYRANOSYL-(1->6)-[BETA-D-GLUCOPYRANOSYL-(1->4)]-BETA-D-GLUCOPYRANOSYL-OLEAN-11,13(18)-DIENE-3-BETA,16-BETA,23,28-TETROL")
| SpectraBase Compound ID | GW84fDCgfB6 |
|---|---|
| InChI | InChI=1S/C48H78O19/c1-43(2)13-14-48(21-52)23(15-43)22-7-8-28-44(3)11-10-30(45(4,20-51)27(44)9-12-46(28,5)47(22,6)16-29(48)53)66-41-38(61)35(58)39(67-42-37(60)34(57)32(55)25(18-50)64-42)26(65-41)19-62-40-36(59)33(56)31(54)24(17-49)63-40/h7-8,24-42,49-61H,9-21H2,1-6H3/t24-,25+,26-,27-,28-,29+,30+,31-,32+,33+,34-,35-,36-,37+,38-,39-,40-,41+,42-,44+,45+,46-,47-,48-/m1/s1 |
| InChIKey | PCWTUTJLXXOQPR-SXRAOTAOSA-N |
| Mol Weight | 959.1 g/mol |
| Molecular Formula | C48H78O19 |
| Exact Mass | 958.51373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dsq6WmoOhJk |
|---|---|
| Name | CLINOPODISIDE-A;#1;3-O-BETA-D-GLUCOPYRANOSYL-(1->6)-[BETA-D-GLUCOPYRANOSYL-(1->4)]-BETA-D-GLUCOPYRANOSYL-OLEAN-11,13(18)-DIENE-3-BETA,16-BETA,23,28-TETROL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O19 |
| InChI | InChI=1S/C48H78O19/c1-43(2)13-14-48(21-52)23(15-43)22-7-8-28-44(3)11-10-30(45(4,20-51)27(44)9-12-46(28,5)47(22,6)16-29(48)53)66-41-38(61)35(58)39(67-42-37(60)34(57)32(55)25(18-50)64-42)26(65-41)19-62-40-36(59)33(56)31(54)24(17-49)63-40/h7-8,24-42,49-61H,9-21H2,1-6H3/t24-,25+,26-,27-,28-,29+,30+,31-,32+,33+,34-,35-,36-,37+,38-,39-,40-,41+,42-,44+,45+,46-,47-,48-/m1/s1 |
| InChIKey | PCWTUTJLXXOQPR-SXRAOTAOSA-N |
| Literature Reference Author | S.R.XUE,J.Q.LIU,G.WANG |
| Literature Reference Citation | PHYTOCHEM.,31,1049(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)80072-m |
| Molecular Weight | 959.136 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN5058 |