![3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL]-22-O-BETA-D-GLUCOPYRANOSYL-SOYASAPOGENOL-B](/api/spectrum/1ITnHfO74bg/structure.png?h=300&w=458 "3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL]-22-O-BETA-D-GLUCOPYRANOSYL-SOYASAPOGENOL-B")
| SpectraBase Compound ID | 2CwRa3Oy5Ay |
|---|---|
| InChI | InChI=1S/C54H88O23/c1-22-31(58)34(61)39(66)45(70-22)76-42-36(63)33(60)26(20-56)72-47(42)77-43-38(65)37(64)41(44(68)69)75-48(43)73-29-12-13-51(5)27(52(29,6)21-57)11-14-54(8)28(51)10-9-23-24-17-49(2,3)18-30(50(24,4)15-16-53(23,54)7)74-46-40(67)35(62)32(59)25(19-55)71-46/h9,22,24-43,45-48,55-67H,10-21H2,1-8H3,(H,68,69)/t22-,24?,25-,26+,27?,28?,29?,30?,31-,32-,33-,34+,35+,36-,37-,38-,39+,40-,41-,42+,43+,45-,46+,47-,48+,50?,51?,52?,53?,54?/m0/s1 |
| InChIKey | VQTMNYUOKHAJED-PSSXFBMRSA-N |
| Mol Weight | 1105.3 g/mol |
| Molecular Formula | C54H88O23 |
| Exact Mass | 1104.571639 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1ITnHfO74bg |
|---|---|
| Name | 3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL]-22-O-BETA-D-GLUCOPYRANOSYL-SOYASAPOGENOL-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H88O23 |
| InChI | InChI=1S/C54H88O23/c1-22-31(58)34(61)39(66)45(70-22)76-42-36(63)33(60)26(20-56)72-47(42)77-43-38(65)37(64)41(44(68)69)75-48(43)73-29-12-13-51(5)27(52(29,6)21-57)11-14-54(8)28(51)10-9-23-24-17-49(2,3)18-30(50(24,4)15-16-53(23,54)7)74-46-40(67)35(62)32(59)25(19-55)71-46/h9,22,24-43,45-48,55-67H,10-21H2,1-8H3,(H,68,69)/t22-,24?,25-,26+,27?,28?,29?,30?,31-,32-,33-,34+,35+,36-,37-,38-,39+,40-,41-,42+,43+,45-,46+,47-,48+,50?,51?,52?,53?,54?/m0/s1 |
| InChIKey | VQTMNYUOKHAJED-PSSXFBMRSA-N |
| Literature Reference Author | A.M.SIMONET,A.STOCHMAL,W.OLESZEK,F.A.MACIAS |
| Literature Reference Citation | PHYTOCHEM.,51,1065(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00192-2 |
| Molecular Weight | 1105.279 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN11022 |