(7S,9S)-7-[(2R,3R,4R,5R,6S)-4,5-二羟基-3-碘-6-甲基氧杂环己-2-基]氧基-6,9,11-三羟基-9-(2-羟基乙酰基)-8,10-二氢-7H-并四苯-5,12-二酮

CAS号
92689-49-1
CCD编号
CCD00179887
分子式
C26 H25 I O11
分子量
640.372

基本信息

产品名称: (7S,9S)-7-[(2R,3R,4R,5R,6S)-4,5-二羟基-3-碘-6-甲基氧杂环己-2-基]氧基-6,9,11-三羟基-9-(2-羟基乙酰基)-8,10-二氢-7H-并四苯-5,12-二酮
CAS: 92689-49-1
中文同义词: (7S,9S)-7-[(2R,3R,4R,5R,6S)-4,5-二羟基-3-碘-6-甲基氧杂环己-2-基]氧基-6,9,11-三羟基-9-(2-羟基乙酰基)-8,10-二氢-7H-并四苯-5,12-二酮
英文同义词: ANNAMYCIN ; (7S,9S)-7-[(2R,3R,4R,5R,6S)-4,5-DIHYDROXY-3-IODO-6-METHYLOXAN-2-YL]OXY-6,9,11-TRIHYDROXY-9-(2-HYDROXYACETYL)-8,10-DIHYDRO-7H-TETRACENE-5,12-DIONE
MDL号: MFCD00914599
氢键受体数量: 11
氢键供体数量: 6
Smile: C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2C[C@@](Cc3c2c(c4c(c3O)C(=O)c5ccccc5C4=O)O)(C(=O)CO)O)I)O)O
InChi: InChI=1S/C26H25IO11/c1-9-19(30)24(35)18(27)25(37-9)38-13-7-26(36,14(29)8-28)6-12-15(13)23(34)17-16(22(12)33)20(31)10-4-2-3-5-11(10)21(17)32/h2-5,9,13,18-19,24-25,28,30,33-36H,6-8H2,1H3/t9-,13-,18+,19-,24-,25-,26-/m0/s1
InChiKey: InChIKey=CIDNKDMVSINJCG-GKXONYSUSA-N

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