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| Standard English name | |
|---|---|
| Cas No. | 19459-68-8 |
| Alias | (3S,5S,8R,9S,10S,13S,14S,16S,17S)-17-acetyl-10,13-dimethyl-12-oxo-16-((R)-2-oxocyclopentyl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl acetate |
| Canonical Smiles | C[C@]12CC[C@@H](C[C@@H]1CC[C@@H]1[C@@H]2CC(=O)[C@]2(C)[C@H]([C@@H](C[C@H]21)[C@H]1CCCC1=O)C(C)=O)OC(C)=O |
| MDL No. | |
| Exact Mass | 456.28758 |
| Smiles | CC([C@H]([C@]12C)[C@H]([C@@H]3C(CCC3)=O)C[C@@]1([H])[C@]4([H])CC[C@@]5([H])C[C@@H](OC(C)=O)CC[C@]5(C)[C@@]4([H])CC2=O)=O |
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| Inchi | InChI=1S/C28H40O5/c1-15(29)26-21(19-6-5-7-24(19)31)13-23-20-9-8-17-12-18(33-16(2)30)10-11-27(17,3)22(20)14-25(32)28(23,26)4/h17-23,26H,5-14H2,1-4H3/t17-,18-,19+,20+,21-,22-,23-,26-,27-,28+/m0/s1 |
| InchiKey | BEJRUZSNNGTWRU-WQSGXIJHSA-N |
| Remark |
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