Identification
Name |
Alldimycin B |
Synonyms |
7,10-Bis[(4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy]-9-Ethyl-1,4,9,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7,10-Bis[(4-Dimethylamino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-9-Ethyl-1,4,9,11-Tetrahydroxy-8,10-Dihydro-7H-T |
|
Molecular Structure |
 |
Molecular Formula |
C36H48N2O12 |
Molecular Weight |
700.78 |
CAS Registry Number |
97605-82-8 |
SMILES |
C1=C5C(=C(O)C3=C1C(OC2OC(C(O)C(N(C)C)C2)C)CC(O)(C3OC4OC(C(O)C(N(C)C)C4)C)CC)C(=O)C6=C(C5=O)C(=CC=C6O)O |
InChI |
1S/C36H48N2O12/c1-8-36(46)14-23(49-24-12-19(37(4)5)30(41)15(2)47-24)17-11-18-26(34(45)29-22(40)10-9-21(39)28(29)32(18)43)33(44)27(17)35(36)50-25-13-20(38(6)7)31(42)16(3)48-25/h9-11,15-16,19-20,23-25,30-31,35,39-42,44,46H,8,12-14H2,1-7H3 |
InChIKey |
JBKZSVYMGSDYJL-UHFFFAOYSA-N |
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