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Product_Name: | 3H-吲哚-3-酮,1,2-二氢-2-(羟基亚甲基)- |
CAS: | 105539-27-3 |
中文同义词: | 3H-吲哚-3-酮,1,2-二氢-2-(羟基亚甲基)- |
EnglishSynonyms: | 25-[N-[(7-NITRO-2-1,3-BENZOXADIAZOL-4-YL)METHYL]AMINO]-27-NORCHOLESTEROL ; 25-NBD CHOLESTEROL |
pro_mdlNumber: | MFCD22416768 |
pro_acceptors: | 8 |
pro_donors: | 1 |
pro_smile: | C[C@H](CCCC(C)N(C)c1ccc(c2c1non2)[N+](=O)[O-])[C@H]3CC[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O)C)C |
InChi: | InChI=1S/C33H48N4O4/c1-20(7-6-8-21(2)36(5)28-13-14-29(37(39)40)31-30(28)34-41-35-31)25-11-12-26-24-10-9-22-19-23(38)15-17-32(22,3)27(24)16-18-33(25,26)4/h9,13-14,20-21,23-27,38H,6-8,10-12,15-19H2,1-5H3/t20-,21?,23+,24+,25-,26+,27+,32+,33-/m1/s1 |
InChiKey: | InChIKey=RMGLSQAGXRZCPZ-NJHFEEIUSA-N |
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