2-((2R,3S,4aR,5aS,6S,8S,9aR,10aS)-6-(benzyloxy)-8-(3-(benzyloxy)propyl)-4a,5a-dimethyl-3-(((Z)-3-(tributylstannyl)prop-1-en-1-yl)oxy)decahydro-2H-dipyrano[3,2-b:2',3'-e]pyran-2-yl)-1-(((2R,4aR,5aS,6aR,8S,9R,10aS,11aR,13aS)-9,10a-dimethyl-2-phenyl-8-vinyldodecahydro-4H-[1,3]dioxino[5,4-b]pyrano[2',3':5,6]pyrano[2,3-f]oxepin-9-yl)oxy)ethyl acetate
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Basic information
| GHS | |
|---|---|
| Exact Mass | 1,326.66046 |
| Smiles | C[C@]12[C@@H](OCC3=CC=CC=C3)C[C@H](CCCOCC3=CC=CC=C3)O[C@]1([H])C[C@@]1([H])[C@](C[C@@H]([C@H](O1)CC(OC(C)=O)O[C@]1([C@H](C=C)O[C@@]3([H])[C@](O[C@@]4([H])[C@]([H])(C3)O[C@@]3([H])[C@](O[C@H](C5=CC=CC=C5)OC3)([H])CC4)(C)C1)C)O/C=C\C[Sn](CCCC)(CCCC)CCCC)(C)O2 |
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| Canonical Smiles | CC(=O)OC(C[C@H]1O[C@H]2C[C@H]3O[C@H](C[C@H](OCC4C=CC=CC=4)[C@]3(C)O[C@]2(C)C[C@@H]1O/C=C\C[Sn](CCCC)(CCCC)CCCC)CCCOCC1C=CC=CC=1)O[C@]1(C)C[C@]2(C)O[C@@H]3CC[C@@H]4O[C@@H](OC[C@H]4O[C@H]3C[C@H]2O[C@H]1C=C)C1C=CC=CC=1 |
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| Inchi | InChI=1S/C61H79O14.3C4H9.Sn/c1-8-29-64-49-35-58(4)53(34-55-61(7,75-58)54(65-37-42-22-15-11-16-23-42)31-44(68-55)26-19-30-63-36-41-20-13-10-14-21-41)70-48(49)33-56(67-40(3)62)74-59(5)39-60(6)52(72-51(59)9-2)32-47-46(73-60)28-27-45-50(69-47)38-66-57(71-45)43-24-17-12-18-25-43;3*1-3-4-2;/h8-18,20-25,29,44-57H,1-2,19,26-28,30-39H2,3-7H3;3*1,3-4H2,2H3;/b29-8-;;;;/t44-,45-,46+,47-,48+,49-,50+,51-,52+,53-,54-,55+,56?,57+,58+,59+,60-,61-;;;;/m0..../s1 |
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| Feature | |
| Useage | |
| InchiKey | PWQKVFNAVDNLPK-CYTSGVMESA-N |
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Security information
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