| CAS Number | 992-62-1 |
| Catalog Number | AG005SR6(AGN-PC-0W955F) |
| Chemical Name | 2-{[4-(3-methoxypyridin-2-yl)butyl]amino}-5-[(6-methylpyridin-3-yl)methyl]pyrimidin-4(3h)-one trihydrochloride |
| IUPAC Name | (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-6-[(2S,3R,4S,6R)-3-hydroxy-6-methyl-4-(methylamino)oxan-2-yl]oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione |
| InChI | InChI=1S/C36H65NO13/c1-13-24-36(10,44)29(40)19(4)26(38)17(2)15-34(8,43)31(50-33-27(39)23(37-11)14-18(3)46-33)20(5)28(21(6)32(42)48-24)49-25-16-35(9,45-12)30(41)22(7)47-25/h17-25,27-31,33,37,39-41,43-44H,13-16H2,1-12H3/t17-,18-,19+,20+,21-,22+,23+,24-,25+,27-,28+,29-,30+,31-,33+,34-,35-,36-/m1/s1 |
| InChI Key | TXOOBKBDBNRQCF-QNPWSHAKSA-N |
| MDL Number | MFCD09840320 |
| Molecular Formula | C36H65NO13 |
| Molecular Weight | 719.9002 |
| SMILES | O([C@@H]1[C@@H](C)[C@H](O[C@H]2C[C@](OC)(C)[C@@H](O)[C@H](C)O2)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)C(=O)[C@H](C)C[C@@]1(C)O)[C@H]3[C@H](O)[C@@H](NC)C[C@@H](C)O3 |
| UNII | 5CUO27O3DC |
| Synonyms | N-Demethylerythromycin A,
N-Demethyl Erythromycin A,
UNII-5CUO27O3DC,
992-62-1,
5CUO27O3DC,
3'-Demethylerythromyon,
Erythromyon, 3'-demethyl-,
Demethylerythromycin,
N-Demethyl-erythromycin,
Des-N-methylerythromycin,
N-Desmethyl Erythromycin,
N-desmethylerythro-mycin a,
SCHEMBL9969016,
CHEMBL2063468,
TXOOBKBDBNRQCF-QNPWSHAKSA-N,
ZINC94303229,
FT-0665707,
11,13-hexamethyl-oxacyclotetradecane-2,10-dione,
(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-6-[(2S,3R,4S,6R)-3-hydroxy-6-methyl-4-(methylamino)oxan-2-yl]oxy-3,5,7,9,,
C36H65NO13,
C36-H65-N-O13,
CS-T-51847,
CID10010092,
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