| SpectraBase Compound ID | 8ZcKVMuEOW7 |
|---|---|
| InChI | InChI=1S/C36H48O19/c1-16-26(41)28(43)30(45)36(52-16)55-33-31(46)35(49-11-10-18-5-8-22(47-2)20(38)12-18)53-24(15-51-34-29(44)27(42)21(39)14-50-34)32(33)54-25(40)9-6-17-4-7-19(37)23(13-17)48-3/h4-9,12-13,16,21,24,26-39,41-46H,10-11,14-15H2,1-3H3/b9-6+/t16-,21-,24-,26-,27-,28+,29+,30+,31-,32-,33-,34+,35-,36-/m0/s1 |
| InChIKey | KLQXMRBGMLHBBQ-OSNJAKDZSA-N |
| Mol Weight | 784.8 g/mol |
| Molecular Formula | C36H48O19 |
| Exact Mass | 784.278979 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5SX1YY9ilSm |
|---|---|
| Name | ANGOROSIDE-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H48O19 |
| InChI | InChI=1S/C36H48O19/c1-16-26(41)28(43)30(45)36(52-16)55-33-31(46)35(49-11-10-18-5-8-22(47-2)20(38)12-18)53-24(15-51-34-29(44)27(42)21(39)14-50-34)32(33)54-25(40)9-6-17-4-7-19(37)23(13-17)48-3/h4-9,12-13,16,21,24,26-39,41-46H,10-11,14-15H2,1-3H3/b9-6+/t16-,21-,24-,26-,27-,28+,29+,30+,31-,32-,33-,34+,35-,36-/m0/s1 |
| InChIKey | KLQXMRBGMLHBBQ-OSNJAKDZSA-N |
| Literature Reference Author | E.KALPOUTZAKIS,N.ALIGIANNIS,S.MITAKOU,A.L.SKALTSOUNIS |
| Literature Reference Citation | J.NAT.PROD.,62,342(1999) |
| Literature Reference DOI | 10.1021/np980351f |
| Molecular Weight | 784.766 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCP6181 |