basic_info |
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| Product_Name: | 5-BETA-PREGNAN-3-ALPHA, 17-DIOL-20-ONE |
| CAS: | 570-52-5 |
| EnglishSynonyms: | 5-BETA-PREGNAN-3-ALPHA, 17-DIOL-20-ONE ; 3ALPHA,17ALPHA-DIHYDROXY-5BETA-PREGNAN-20-ONE ; 5BETA-PREGNANE-3ALPHA,17ALPHA-DIOL-20-ONE ; 17ALPHA-HYDROXYPREGNANOLONE ; 17-ALPHA-HYDROXYEPIPREGNANOLONE ; 5BETA-PREGNAN-3ALPHA,17ALPHA-DIOL-20-ONE ; 5BETA-PREGNAN-3BETA,17-DIOL-20-ONE ; 3-ALPHA,17-ALPHA-DIHYDROXY-5-BETA-PREGNANE-20-ONE |
| pro_mdlNumber: | MFCD00069487 |
| pro_acceptors: | 3 |
| pro_donors: | 2 |
| pro_smile: | CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C)O |
| InChi: | InChI=1S/C21H34O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h14-18,23-24H,4-12H2,1-3H3/t14-,15-,16-,17+,18+,19+,20+,21+/m1/s1 |
| InChiKey: | InChIKey=LKQDFQLSEHWIRK-UKBVDAKRSA-N |
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