![(2R,17Z)-N-[(1S,2S,3R,7Z)-1-[(BETA-D-GLUCOPYRANOSYL-OXY)-METHYL]-2,3-DIHYDROXY-HEPTADEC-7-EN-1-YL]-2-HYDROXY-HEXACOS-17-EN-AMIDE](/api/spectrum/9T2YvrrFtUy/structure.png?h=300&w=458 "(2R,17Z)-N-[(1S,2S,3R,7Z)-1-[(BETA-D-GLUCOPYRANOSYL-OXY)-METHYL]-2,3-DIHYDROXY-HEPTADEC-7-EN-1-YL]-2-HYDROXY-HEXACOS-17-EN-AMIDE")
| SpectraBase Compound ID | CpoKnbojCjQ |
|---|---|
| InChI | InChI=1S/C50H95NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-43(54)49(59)51-41(40-60-50-48(58)47(57)46(56)44(39-52)61-50)45(55)42(53)37-35-33-31-29-27-16-14-12-10-8-6-4-2/h17-18,29,31,41-48,50,52-58H,3-16,19-28,30,32-40H2,1-2H3,(H,51,59)/b18-17-,31-29-/t41-,42+,43+,44-,45-,46-,47+,48-,50-/m0/s1 |
| InChIKey | UVFYANYUVOLGBR-FBSQZGFWSA-N |
| Mol Weight | 870.3 g/mol |
| Molecular Formula | C50H95NO10 |
| Exact Mass | 869.695598 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9T2YvrrFtUy |
|---|---|
| Name | (2R,17Z)-N-[(1S,2S,3R,7Z)-1-[(BETA-D-GLUCOPYRANOSYL-OXY)-METHYL]-2,3-DIHYDROXY-HEPTADEC-7-EN-1-YL]-2-HYDROXY-HEXACOS-17-EN-AMIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H95NO10 |
| InChI | InChI=1S/C50H95NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-43(54)49(59)51-41(40-60-50-48(58)47(57)46(56)44(39-52)61-50)45(55)42(53)37-35-33-31-29-27-16-14-12-10-8-6-4-2/h17-18,29,31,41-48,50,52-58H,3-16,19-28,30,32-40H2,1-2H3,(H,51,59)/b18-17-,31-29-/t41-,42+,43+,44-,45-,46-,47+,48-,50-/m0/s1 |
| InChIKey | UVFYANYUVOLGBR-FBSQZGFWSA-N |
| Literature Reference Author | F.CATENI,J.ZILIC,M.ZACCHIGNA |
| Literature Reference Citation | SCI.PHARM.,76,451(2008) |
| Literature Reference DOI | 10.3797/scipharm.0805-03 |
| Molecular Weight | 870.305 g/mol |
| Sample ID | 2935 |
| Solvent | C5D5N |