| SpectraBase Compound ID | 4MFbkuQ24aL |
|---|---|
| InChI | InChI=1S/C58H80O27/c1-26-44(47(70-11)50(79-32(7)65)54(74-26)82-37-14-18-57(25-59)36(21-37)12-13-40-39(57)15-17-56(10)38(16-19-58(40,56)69)35-20-43(68)72-22-35)85-55-52(81-34(9)67)49(78-31(6)64)46(76-29(4)62)42(84-55)24-73-53-51(80-33(8)66)48(77-30(5)63)45(75-28(3)61)41(83-53)23-71-27(2)60/h20,25-26,36-42,44-55,69H,12-19,21-24H2,1-11H3/t26-,36+,37-,38+,39-,40+,41-,42-,44-,45-,46-,47+,48+,49+,50-,51-,52-,53-,54-,55+,56+,57+,58-/m0/s1 |
| InChIKey | BODNAXGZMZECKO-UBHMVDJOSA-N |
| Mol Weight | 1209.3 g/mol |
| Molecular Formula | C58H80O27 |
| Exact Mass | 1208.488697 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7RBP1Pi352F |
|---|---|
| Name | PERACETYLTHEVETIN-A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H80O27 |
| InChI | InChI=1S/C58H80O27/c1-26-44(47(70-11)50(79-32(7)65)54(74-26)82-37-14-18-57(25-59)36(21-37)12-13-40-39(57)15-17-56(10)38(16-19-58(40,56)69)35-20-43(68)72-22-35)85-55-52(81-34(9)67)49(78-31(6)64)46(76-29(4)62)42(84-55)24-73-53-51(80-33(8)66)48(77-30(5)63)45(75-28(3)61)41(83-53)23-71-27(2)60/h20,25-26,36-42,44-55,69H,12-19,21-24H2,1-11H3/t26-,36+,37-,38+,39-,40+,41-,42-,44-,45-,46-,47+,48+,49+,50-,51-,52-,53-,54-,55+,56+,57+,58-/m0/s1 |
| InChIKey | BODNAXGZMZECKO-UBHMVDJOSA-N |
| Literature Reference Author | K.TORI,T.T.THANG,M.SANGARE,G.LUKACS |
| Literature Reference Citation | TETRAH.LETT.,18,717(1977) |
| Literature Reference DOI | 10.1016/S0040-4039(01)92735-2 |
| Molecular Weight | 1209.257 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UNIW8451 |