| SpectraBase Compound ID | ICI71Hb8eir |
|---|---|
| InChI | InChI=1S/C39H50O23/c1-11-21(42)26(47)30(51)36(55-11)54-10-19-24(45)29(50)35(62-38-32(53)28(49)23(44)13(3)57-38)39(60-19)61-34-25(46)20-17(41)8-16(58-37-31(52)27(48)22(43)12(2)56-37)9-18(20)59-33(34)14-4-6-15(40)7-5-14/h4-9,11-13,19,21-24,26-32,35-45,47-53H,10H2,1-3H3/t11-,12+,13-,19+,21-,22+,23-,24-,26+,27-,28+,29-,30+,31-,32+,35+,36+,37+,38-,39-/m0/s1 |
| InChIKey | HRPKYCPCIPYAQZ-YXDMRQFKSA-N |
| Mol Weight | 886.8 g/mol |
| Molecular Formula | C39H50O23 |
| Exact Mass | 886.274288 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8CCvfSfwQIG |
|---|---|
| Name | DESACYL-GLADIATOSIDE-B |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H50O23 |
| InChI | InChI=1S/C39H50O23/c1-11-21(42)26(47)30(51)36(55-11)54-10-19-24(45)29(50)35(62-38-32(53)28(49)23(44)13(3)57-38)39(60-19)61-34-25(46)20-17(41)8-16(58-37-31(52)27(48)22(43)12(2)56-37)9-18(20)59-33(34)14-4-6-15(40)7-5-14/h4-9,11-13,19,21-24,26-32,35-45,47-53H,10H2,1-3H3/t11-,12+,13-,19+,21-,22+,23-,24-,26+,27-,28+,29-,30+,31-,32+,35+,36+,37+,38-,39-/m0/s1 |
| InChIKey | HRPKYCPCIPYAQZ-YXDMRQFKSA-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 | 886.812 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN4659 |