| SpectraBase Compound ID | 3L0QKdomU3X |
|---|---|
| InChI | InChI=1S/C41H28O26/c42-11-1-7(2-12(43)23(11)47)37(58)64-16-6-63-38(59)8-3-13(44)24(48)27(51)17(8)18-9(4-14(45)25(49)28(18)52)39(60)65-34(16)36-35-32(56)22-21(41(62)66-35)20(30(54)33(57)31(22)55)19-10(40(61)67-36)5-15(46)26(50)29(19)53/h1-5,16,32,34-36,42-57H,6H2/t16-,32+,34-,35-,36-/m0/s1 |
| InChIKey | MMQXBTULXAEKQE-NXROWURCSA-N |
| Mol Weight | 936.6 g/mol |
| Molecular Formula | C41H28O26 |
| Exact Mass | 936.086881 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5qbQrIjmrty |
|---|---|
| Name | STACHYURIN |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H28O26 |
| InChI | InChI=1S/C41H28O26/c42-11-1-7(2-12(43)23(11)47)37(58)64-16-6-63-38(59)8-3-13(44)24(48)27(51)17(8)18-9(4-14(45)25(49)28(18)52)39(60)65-34(16)36-35-32(56)22-21(41(62)66-35)20(30(54)33(57)31(22)55)19-10(40(61)67-36)5-15(46)26(50)29(19)53/h1-5,16,32,34-36,42-57H,6H2/t16-,32+,34-,35-,36-/m0/s1 |
| InChIKey | MMQXBTULXAEKQE-NXROWURCSA-N |
| Literature Reference Author | H.ITO,K.MIKI,T.YOSHIDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,47,536(1999) |
| Literature Reference DOI | 10.1248/cpb.47.536 |
| Molecular Weight | 936.658 g/mol |
| Solvent | ACETONE-D6:D2O |
| Source File Reference | UWLU7944 |