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脱水差向四环素
Anhydrotetracyclin
脱水四环素, 5a,6-Anhydrotetracycline, Anhydrotetracyclin
CAS号: 1665-56-1
IUPAC名称: (4S,4aS,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide
分子式: C22H22N2O7
分子量: 426.41900
InChI: InChI=1S/C22H22N2O7/c1-8-9-5-4-6-12(25)13(9)17(26)14-10(8)7-11-16(24(2)3)18(27)15(21(23)30)20(29)22(11,31)19(14)28/h4-6,11,16,25-26,29,31H,7H2,1-3H3,(H2,23,30)/t11-,16-,22-/m0/s1
InChIKey: KTTKGQINVKPHLY-DOCRCCHOSA-N
SMILES: CC1=C2C=CC=C(C2=C(C3=C1C[C@H]4[C@@H](C(=O)C(=C([C@]4(C3=O)O)O)C(=O)N)N(C)C)O)O
EINECS: -
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