basic_info |
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Product_Name: | BENZENESULFONIC ACID, 4-METHYL-, [(3BETA,5ALPHA)-3-HYDROXYANDROSTAN-17-YLIDENE]HYDRAZIDE |
CAS: | 84955-29-3 |
EnglishSynonyms: | BENZENESULFONIC ACID, 4-METHYL-, [(3BETA,5ALPHA)-3-HYDROXYANDROSTAN-17-YLIDENE]HYDRAZIDE |
pro_mdlNumber: | MFCD21608609 |
pro_acceptors: | 5 |
pro_donors: | 2 |
pro_smile: | Cc1ccc(cc1)S(=O)(=O)N/N=C/2\CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC[C@@H]5[C@@]4(CC[C@@H](C5)O)C)C |
InChi: | InChI=1S/C26H38N2O3S/c1-17-4-7-20(8-5-17)32(30,31)28-27-24-11-10-22-21-9-6-18-16-19(29)12-14-25(18,2)23(21)13-15-26(22,24)3/h4-5,7-8,18-19,21-23,28-29H,6,9-16H2,1-3H3/b27-24+/t18-,19-,21-,22-,23-,25-,26-/m0/s1 |
InChiKey: | InChIKey=NEAZTFMKMHWEKU-VJXOUEEESA-N |
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