| CAS Number | 612069-25-7 |
| Catalog Number | AG00EEP1(AGN-PC-0SZBOT) |
| Chemical Name | (2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-11-[[4,6-Dideoxy-β-D-erythro-hexopyranos-3-ulos-1-yl]oxy]-13-[(2,6-dideoxy-3-C-methyl-3-O-methyl-α-L-ribo-hexopyranosyl)oxy]-2-ethyl-3,4,10-trihydroxy-3,5,6,8,10,12,14-heptamethyl-1-oxa-6-azacyclopentadecan-15-one |
| IUPAC Name | (2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-2-ethyl-3,4,10-trihydroxy-13-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-11-[(2S,3S,6R)-3-hydroxy-6-methyl-4-oxooxan-2-yl]oxy-3,5,6,8,10,12,14-heptamethyl-1-oxa-6-azacyclopentadecan-15-one |
| InChI | InChI=1S/C36H65NO13/c1-13-25-36(10,44)29(40)22(6)37(11)17-18(2)15-34(8,43)31(50-33-27(39)24(38)14-19(3)46-33)20(4)28(21(5)32(42)48-25)49-26-16-35(9,45-12)30(41)23(7)47-26/h18-23,25-31,33,39-41,43-44H,13-17H2,1-12H3/t18-,19-,20+,21-,22-,23+,25-,26+,27-,28+,29-,30+,31-,33+,34-,35-,36-/m1/s1 |
| InChI Key | AMNAVVMCWWSBHN-AWHKAWBESA-N |
| MDL Number | MFCD31630987 |
| 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)N(C)C[C@H](C)C[C@@]1(C)O)[C@H]3[C@H](O)C(=O)C[C@@H](C)O3 |
| UNII | RMC18HT68M |
| Synonyms | UNII-RMC18HT68M,
RMC18HT68M,
3'-De(dimethylamino)-3'-oxoazithromycin,
612069-25-7,
DTXSID20210124,
ZINC94303250,
3'-Des(dimethylamino)-3'-keto Azithromycin,
FT-0665957,
J3.496.475K,
3 inverted exclamation mark -De(dimethylamino)-3 inverted exclamation mark -oxoazithromycin,
3''-N,3''-N-Didemethyl-3''-deamino-3''-oxo-9-deoxo-9a-methyl-9a-aza-9a-homoerythromycin,
(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-11-[[4,6-dideoxy-|A-D-erythro-hexopyranos-3-ulos-1-yl]oxy]-13-[(2,6-dideoxy-3-C-methyl-3-O-methyl-|A-L-ribo-hexopyranosyl)oxy]-2-ethyl-3,4,10-trihydroxy-3,5,6,8,10,12,14-heptamethyl-1-oxa-6-azacyclopentadecan-15-one,
3/'-DE(Dimethylamino)-3/'-oxoazithromycin,
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