| SpectraBase Compound ID | C3vATk9aSTX |
|---|---|
| InChI | InChI=1S/C46H50O23/c47-18-36-42(68-37(57)8-3-20-1-5-26(48)29(51)11-20)43(69-45-40(60)39(59)34(56)19-65-45)41(61)46(67-36)64-10-9-23-15-32(54)33(55)16-24(23)25(22-4-7-28(50)31(53)14-22)17-38(58)66-35(44(62)63)13-21-2-6-27(49)30(52)12-21/h1-8,11-12,14-16,25,34-36,39-43,45-56,59-61H,9-10,13,17-19H2,(H,62,63)/b8-3+/t25-,34-,35-,36+,39+,40-,41+,42+,43+,45+,46+/m1/s1 |
| InChIKey | AFLXZWMGCPTXOJ-NIQVSCDUSA-N |
| Mol Weight | 970.9 g/mol |
| Molecular Formula | C46H50O23 |
| Exact Mass | 970.274288 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ITEoWn4F7Hs |
|---|---|
| Name | (7R,8'R)-MEEHANIOSIDE-C |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H50O23 |
| InChI | InChI=1S/C46H50O23/c47-18-36-42(68-37(57)8-3-20-1-5-26(48)29(51)11-20)43(69-45-40(60)39(59)34(56)19-65-45)41(61)46(67-36)64-10-9-23-15-32(54)33(55)16-24(23)25(22-4-7-28(50)31(53)14-22)17-38(58)66-35(44(62)63)13-21-2-6-27(49)30(52)12-21/h1-8,11-12,14-16,25,34-36,39-43,45-56,59-61H,9-10,13,17-19H2,(H,62,63)/b8-3+/t25-,34-,35-,36+,39+,40-,41+,42+,43+,45+,46+/m1/s1 |
| InChIKey | AFLXZWMGCPTXOJ-NIQVSCDUSA-N |
| Literature Reference Author | T.MURATA,T.MIYASE,F.YOSHIZAKI |
| Literature Reference Citation | CHEM.PHARM.BULL.,59,88(2011) |
| Literature Reference DOI | 10.1248/cpb.59.88 |
| Molecular Weight | 970.889 g/mol |
| Sample ID | 2641 |
| Solvent | CD3OD |