| SpectraBase Compound ID | 5sGlDzw9Men |
|---|---|
| InChI | InChI=1S/C42H66O20/c1-17(8-9-55-37(53)23-15-57-39(29-19(3)25(45)10-21(23)29)61-41-35(51)33(49)31(47)27(12-43)59-41)6-5-7-18(2)14-56-38(54)24-16-58-40(30-20(4)26(46)11-22(24)30)62-42-36(52)34(50)32(48)28(13-44)60-42/h15-22,25-36,39-52H,5-14H2,1-4H3/t17?,18?,19-,20-,21+,22+,25-,26-,27-,28-,29+,30+,31-,32-,33+,34+,35-,36-,39-,40-,41+,42+/m0/s1 |
| InChIKey | VZQCFXUMFURPPF-NONSRNQWSA-N |
| Mol Weight | 891.0 g/mol |
| Molecular Formula | C42H66O20 |
| Exact Mass | 890.414745 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C1Pc30aTdPb |
|---|---|
| Name | PREMNAODOROSIDE-D |
| Compound Number | 413 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H66O20 |
| InChI | InChI=1S/C42H66O20/c1-17(8-9-55-37(53)23-15-57-39(29-19(3)25(45)10-21(23)29)61-41-35(51)33(49)31(47)27(12-43)59-41)6-5-7-18(2)14-56-38(54)24-16-58-40(30-20(4)26(46)11-22(24)30)62-42-36(52)34(50)32(48)28(13-44)60-42/h15-22,25-36,39-52H,5-14H2,1-4H3/t17?,18?,19-,20-,21+,22+,25-,26-,27-,28-,29+,30+,31-,32-,33+,34+,35-,36-,39-,40-,41+,42+/m0/s1 |
| InChIKey | VZQCFXUMFURPPF-NONSRNQWSA-N |
| Literature Reference Author | B.DINDA,S.DEBNATH,Y.HARIGAYA |
| Literature Reference Citation | CHEM.PHARM.BULL.,55,159(2007) |
| Literature Reference DOI | 10.1248/cpb.55.159 |
| Molecular Weight | 890.974 g/mol |
| Sample ID | 38207 |
| Solvent | CD3OD |