| SpectraBase Compound ID | Ic6QxeYs6EK |
|---|---|
| InChI | InChI=1S/C70H114O8/c1-9-11-13-15-17-19-21-23-24-25-27-29-31-33-35-42-65(73)78-48-38-41-61-59(56(6)53-71)43-46-68(7,76)70(61)47-44-60(66(70)74)57-50-58(49-55(5)40-37-39-54(3)4)69(62(51-57)63(72)52-64(77-8)67(69)75)45-36-34-32-30-28-26-22-20-18-16-14-12-10-2/h16,18,39,49-50,52-53,58,60-62,66,74,76H,9-15,17,19-38,40-48,51H2,1-8H3/b18-16-,55-49+,59-56+/t58-,60-,61+,62+,66+,68-,69+,70-/m0/s1 |
| InChIKey | CKKUBPSGUNCJFT-HXPHEVGVSA-N |
| Mol Weight | 1083.7 g/mol |
| Molecular Formula | C70H114O8 |
| Exact Mass | 1082.851371 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4e4TiyRkHZQ |
|---|---|
| Name | IRISTECTORONE-H |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C70H114O8 |
| InChI | InChI=1S/C70H114O8/c1-9-11-13-15-17-19-21-23-24-25-27-29-31-33-35-42-65(73)78-48-38-41-61-59(56(6)53-71)43-46-68(7,76)70(61)47-44-60(66(70)74)57-50-58(49-55(5)40-37-39-54(3)4)69(62(51-57)63(72)52-64(77-8)67(69)75)45-36-34-32-30-28-26-22-20-18-16-14-12-10-2/h16,18,39,49-50,52-53,58,60-62,66,74,76H,9-15,17,19-38,40-48,51H2,1-8H3/b18-16-,55-49+,59-56+/t58-,60-,61+,62+,66+,68-,69+,70-/m0/s1 |
| InChIKey | CKKUBPSGUNCJFT-HXPHEVGVSA-N |
| Literature Reference Author | K.SEKI,T.TOMIHARI,K.HAGA,R.KANEKO |
| Literature Reference Citation | PHYTOCHEM.,37,807(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90362-5 |
| Molecular Weight | 1083.670 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU23491 |