| SpectraBase Compound ID | Hhq8zP5U9OR |
|---|---|
| InChI | InChI=1S/C39H50O24/c1-11-21(43)26(48)30(52)36(56-11)55-10-19-24(46)29(51)35(63-38-32(54)28(50)23(45)18(9-40)60-38)39(61-19)62-34-25(47)20-16(42)7-15(58-37-31(53)27(49)22(44)12(2)57-37)8-17(20)59-33(34)13-3-5-14(41)6-4-13/h3-8,11-12,18-19,21-24,26-32,35-46,48-54H,9-10H2,1-2H3/t11-,12+,18+,19+,21-,22+,23+,24-,26+,27-,28-,29-,30+,31-,32+,35+,36+,37+,38-,39-/m0/s1 |
| InChIKey | CGBWBDPNSXERKW-GGVPCXDQSA-N |
| Mol Weight | 902.8 g/mol |
| Molecular Formula | C39H50O24 |
| Exact Mass | 902.269202 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9QQ3ejyuPhv |
|---|---|
| Name | DESACYL-GLADIATOSIDE-A |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H50O24 |
| InChI | InChI=1S/C39H50O24/c1-11-21(43)26(48)30(52)36(56-11)55-10-19-24(46)29(51)35(63-38-32(54)28(50)23(45)18(9-40)60-38)39(61-19)62-34-25(47)20-16(42)7-15(58-37-31(53)27(49)22(44)12(2)57-37)8-17(20)59-33(34)13-3-5-14(41)6-4-13/h3-8,11-12,18-19,21-24,26-32,35-46,48-54H,9-10H2,1-2H3/t11-,12+,18+,19+,21-,22+,23+,24-,26+,27-,28-,29-,30+,31-,32+,35+,36+,37+,38-,39-/m0/s1 |
| InChIKey | CGBWBDPNSXERKW-GGVPCXDQSA-N |
| Literature Reference Author | T.MURAKAMI,K.KOHNO,A.KISHI,H.MATSUDA,M.YOSHIKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,48,1673(2000) |
| Literature Reference DOI | 10.1248/cpb.48.1673 |
| Molecular Weight | 902.812 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN4655 |