basic_info |
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| Product_Name: | 对氮蒽蓝 |
| CAS: | 8004-98-6 ;12771-92-5 |
| 中文同义词: | 对氮蒽蓝 ; 2H-1,2-噁嗪-2-乙酸, 四氢-5-羟基-a-甲基-3-羰基- |
| EnglishSynonyms: | SPIRIT NIGROSIN R ; ACETIN BLUE ; INDULIN ; SPIRIT INDULIN |
| pro_mdlNumber: | MFCD00078245 |
| pro_acceptors: | 6 |
| pro_donors: | 4 |
| pro_smile: | c1ccc(cc1)Nc2cc3c(cc2Nc4ccccc4)[n+](c5cc(c(cc5n3)N)N)c6ccccc6.[Cl-] |
| InChi: | InChI=1S/C30H24N6.ClH/c31-23-16-27-29(17-24(23)32)36(22-14-8-3-9-15-22)30-19-26(34-21-12-6-2-7-13-21)25(18-28(30)35-27)33-20-10-4-1-5-11-20;/h1-19H,(H5,31,32,33,34,35);1H |
| InChiKey: | InChIKey=ZMWAXVAETNTVAT-UHFFFAOYSA-N |
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