| SpectraBase Compound ID | CX3O9lNx6Ao |
|---|---|
| InChI | InChI=1S/C40H46O21/c1-18(41)51-17-32-35(57-22(5)45)36(58-23(6)46)37(59-24(7)47)40(60-32)61-39-34-26(27(15-53-39)38(49)50-8)14-30(55-20(3)43)28(34)16-52-33(48)12-10-25-9-11-29(54-19(2)42)31(13-25)56-21(4)44/h9-13,15,26,28,30,32,34-37,39-40H,14,16-17H2,1-8H3/b12-10+/t26-,28+,30+,32+,34+,35+,36-,37+,39+,40-/m1/s1 |
| InChIKey | GTAAKVKZUSOBGG-BBNNIIRISA-N |
| Mol Weight | 862.8 g/mol |
| Molecular Formula | C40H46O21 |
| Exact Mass | 862.253158 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HUDHnIOiMPI |
|---|---|
| Name | (E)-HEPTAACETYL-10-(3,4-DIHYDROXYCINNAMOYLOXY)-LOGANIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H46O21 |
| InChI | InChI=1S/C40H46O21/c1-18(41)51-17-32-35(57-22(5)45)36(58-23(6)46)37(59-24(7)47)40(60-32)61-39-34-26(27(15-53-39)38(49)50-8)14-30(55-20(3)43)28(34)16-52-33(48)12-10-25-9-11-29(54-19(2)42)31(13-25)56-21(4)44/h9-13,15,26,28,30,32,34-37,39-40H,14,16-17H2,1-8H3/b12-10+/t26-,28+,30+,32+,34+,35+,36-,37+,39+,40-/m1/s1 |
| InChIKey | GTAAKVKZUSOBGG-BBNNIIRISA-N |
| Literature Reference Author | R.BENKRIEF,A.L.SKALTSOUNIS,F.TILLEQUIN,M.KOCH,J.PUSSET |
| Literature Reference Citation | J.NAT.PROD.,54,532(1991) |
| Literature Reference DOI | 10.1021/np50074a028 |
| Molecular Weight | 862.793 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS1183 |