| SpectraBase Compound ID | HgYnbfhwlo |
|---|---|
| InChI | InChI=1S/C48H67NO18/c1-23(2)15-17-49-35-40(65-34(52)18-30(51)27-10-8-7-9-11-27)39(66-43-38(55)37(54)36(53)25(4)62-43)31(22-61-67-26(5)50)64-42(35)63-29-20-46(6)32-13-12-28-19-47(32,41(56)24(28)3)16-14-33(46)48(21-29,44(57)58)45(59)60/h7-11,17,23,25,28-33,35-43,51,53-56H,3,12-16,18-22H2,1-2,4-6H3,(H,57,58)(H,59,60)/b49-17+/t25?,28-,29+,30?,31?,32+,33+,35?,36?,37?,38?,39?,40?,41+,42?,43?,46+,47-/m1/s1 |
| InChIKey | CGGSVOPXJGNNCI-HENXXENRSA-N |
| Mol Weight | 946.1 g/mol |
| Molecular Formula | C48H67NO18 |
| Exact Mass | 945.435814 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4saw6kL5JZv |
|---|---|
| Name | BIFLORATOXIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H67NO18 |
| InChI | InChI=1S/C48H67NO18/c1-23(2)15-17-49-35-40(65-34(52)18-30(51)27-10-8-7-9-11-27)39(66-43-38(55)37(54)36(53)25(4)62-43)31(22-61-67-26(5)50)64-42(35)63-29-20-46(6)32-13-12-28-19-47(32,41(56)24(28)3)16-14-33(46)48(21-29,44(57)58)45(59)60/h7-11,17,23,25,28-33,35-43,51,53-56H,3,12-16,18-22H2,1-2,4-6H3,(H,57,58)(H,59,60)/b49-17+/t25?,28-,29+,30?,31?,32+,33+,35?,36?,37?,38?,39?,40?,41+,42?,43?,46+,47-/m1/s1 |
| InChIKey | CGGSVOPXJGNNCI-HENXXENRSA-N |
| Literature Reference Author | J.K.MACLEOD,K.L.GAUL,P.B.OELRICHS |
| Literature Reference Citation | AUSTR.J.CHEM.,43,1533(1990) |
| Literature Reference DOI | 10.1071/ch9901533 |
| Molecular Weight | 946.056 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWED9559 |