(1S,3aS,9aR,14bR,15aS)-1-hydroxy-1-(3-hydroxyprop-1-yn-1-yl)-15a-methyl-12-(tributylstannyl)-3,3a,4,5,8,9,10,14b,15,15a-decahydro-1H-benzo[n]indeno[4,5,6-de]anthracen-7(2H)-one
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Basic information
| GHS | |
|---|---|
| Exact Mass | 704.32514 |
| Smiles | C[C@]12C[C@@]3([H])C4=C(CCC5[C@]4(CC4=CC([Sn](CCCC)(CCCC)CCCC)=CC=C43)CCC(=O)C=5)[C@]1([H])CC[C@@]2(O)C#CCO |
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| Canonical Smiles | C[C@]12C[C@H]3C4=C(CCC5=CC(=O)CC[C@@]54CC4=CC(=CC=C43)[Sn](CCCC)(CCCC)CCCC)[C@@H]1CC[C@@]2(O)C#CCO |
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| Inchi | InChI=1S/C28H29O3.3C4H9.Sn/c1-26-17-23-21-6-3-2-5-18(21)16-27-12-9-20(30)15-19(27)7-8-22(25(23)27)24(26)10-13-28(26,31)11-4-14-29;3*1-3-4-2;/h3,5-6,15,23-24,29,31H,7-10,12-14,16-17H2,1H3;3*1,3-4H2,2H3;/t23-,24+,26+,27-,28+;;;;/m1..../s1 |
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| InchiKey | FTTKWCCBPIRWBS-HJHFACPFSA-N |
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