Erythromycin ethylsuccinate
CAS Number: 1264-62-6
Molecular Mass: 862.1 g/mol
Formula: C43H75NO16
Smiles: CCOC(=O)CCC(=O)O[C@H]1[C@H](O[C@@H]2[C@@H](C)[C@H](O[C@H]3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[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@@]2(C)O)O[C@H](C)C[C@@H]1N(C)C
Synonymes:
Erythromycin ethylsuccinate, erythromycin ethylsuccinate, 1264-62-6, Erythromycin ethyl succinate, Erythrocin ethyl succinate, anamycin, arpimycin, Wyamycin, ERY-PED, PEDIAMYCIN 400, Erythromycin, ethyl succinate, Erythromycin 2'-(ethyl butanedioate), Esinol, Erythromycin, mono(ethyl succinate), NSC-756758, ERYLIQUID, REFKAS, DTXSID4022993, 1014KSJ86F, Erythromycin, mono(ethyl succinate) (ester), Succinic acid, monoethyl ester, monoester with erythromycin, E.E.S 200, E.E.S 400, DTXCID902993, 4-O-[(2S,3R,4S,6R)-4-(dimethylamino)-2-[[(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-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-6-methyloxan-3-yl] 1-O-ethyl butanedioate, CHEBI:31555, 41342-53-4, Eyrthromycin Ethyl Succinate, Erythroden, Erymin, Erythroped fte, Erythroped pi, Erythroped sf, Erythroped a, Erythroped pi sf, Erythroped fte sf, 4-O-((2S,3R,4S,6R)-4-(dimethylamino)-2-(((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-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl)oxy)-6-methyloxan-3-yl) 1-O-ethyl butanedioate, E.E.S. 200, E.E.S. 400, Rommix 125, RefChem:55126, erythromycini ethylsuccinas, Ethylsuccinate, Erythromycin, Ethyl Succinate, Eyrthromycin, Succinate, Eyrthromycin Ethyl, (2R,3S,4S,5R,6R,8R,10R,11R,12S,13R)-5-(3,4,6-Trideoxy-2-O-(3-ethoxycarbonylpropanoyl)-3-dimethylamino-beta-D-xylo-hexopyranosyloxy)-3-(2,6-dideoxy-3-C-methyl-3-O-methyl-alpha-L-ribo-hexopyranosyloxy)-6,11,12-trihydroxy-2,4,6,8,10,12-hexamethyl-9-oxopentadecan-13-olide, 215-033-8, Eritrocina, Primacine, Pediamycin, Erythroped, EryPed, Wyamycin E, E.E.S., MLS001074901, C43H75NO16, MFCD00084692, SMR000058868, Erythromycin 2'-(ethyl succinate), EES Granules, E.E.S, O4-[(2S,3R,4S,6R)-4-(dimethylamino)-2-[[(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-dimethyl-tetrahydropyran-2-yl]oxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-6-methyl-tetrahydropyran-3-yl] O1-ethyl butanedioate, EES (Antiobiotic), HSDB 3075, Erythromycin ethylsuccinate [JAN], EINECS 215-033-8, BRN 0077638, UNII-1014KSJ86F, NCGC00183038-01, E-Mycin-E, Eryped (TN), DURAPAEDIAT, Erythrocin W (TN), Erythromycin ethylsuccinate [USP:JAN], Spectrum_001046, Spectrum2_000983, Spectrum3_000419, Spectrum4_000536, Spectrum5_000668, erythromycin-ethylsuccinate, Erythromycin-ethyl succinate, SCHEMBL18259, BSPBio_001978, KBioGR_001171, KBioSS_001526, 4-18-00-07416 (Beilstein Handbook Reference), MLS000028651, MLS001076672, DivK1c_000764, Erythromycin ethylsuccinate RS, SPECTRUM1500279, SPBio_001045, Erythromycin ethylsuccinate CRS, cid_443953, orb1310577, CHEMBL1200688, BDBM96262, E.E.S. (TN), HMS502G06, KBio1_000764, KBio2_001526, KBio2_004094, KBio2_006662, KBio3_001198, NINDS_000764, Sterile erythromycin ethylsuccinate, GLXC-07736, HMS1923I21, HMS2091D03, Pharmakon1600-01500279, HY-B0957, 2'-(Ethyl butanedioate)erythromycin, Tox21_113497, CCG-40201, LMPK05000001, MSK158695, NSC756758, s4060, AKOS008145410, CS-4434, MSK158695-100A, NSC 756758, Erythromycin ethylsuccinate (JP18/USP), ERYTHROMYCIN ETHYLSUCCINATE [MI], IDI1_000764, ERYTHROMYCIN (AS ETHYL SUCCINATE), NCGC00021382-03, ERYTHROMYCIN ETHYLSUCCINATE [HSDB], FE170906, CAS-1264-62-6, ERYTHROMYCIN ETHYLSUCCINATE [VANDF], SBI-0051367.P003, ERYTHROMYCIN ETHYLSUCCINATE [USP-RS], ERYTHROMYCIN ETHYLSUCCINATE [WHO-DD], ERYTHROMYCIN ETHYLSUCCINATE [WHO-IP], ERYTHROMYCIN ETHYL SUCCINATE [MART.], D01361, AB00051980_11, AB00051980_12, ERYTHROMYCIN ETHYLSUCCINATE [ORANGE BOOK], ERYTHROMYCIN ETHYLSUCCINATE [EP MONOGRAPH], ERYTHROMYCIN ETHYLSUCCINATE [USP MONOGRAPH], ERYTHROMYCINI ETHYLSUCCINAS [WHO-IP LATIN], SR-05000001617, ERYZOLE COMPONENT ERYTHROMYCIN ETHYLSUCCINATE, SR-05000001617-1, BRD-K51677086-001-12-0, BRD-K51677086-001-13-8, PEDIAZOLE COMPONENT ERYTHROMYCIN ETHYLSUCCINATE, Q27114406, Z608353986, STERILE ERYTHROMYCIN ETHYLSUCCINATE [USP MONOGRAPH], Erythromycin ethylsuccinate for impurity P identification CRS, Erythromycin ethylsuccinate Solution in Acetonitrile, 100ug/mL, (2S,3R,4S,6R)-4-(dimethylamino)-2-(((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-dimethyltetrahydro-2H-pyran-2-yl)oxy)-3,5,7,9,11,13-hexamethyl-2,10-dioxooxacyclotetradecan-6-yl)oxy)-6-methyltetrahydro-2H-pyran-3-yl ethyl succinate, (2S,3R,4S,6R)-4-(Dimethylamino)-2-{[(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}-3,5,7,9,11,13-hexamethyl-2,10-dioxo-1-oxacyclotetradecan-6-yl]oxy}-6-methyloxan-3-yl ethyl butanedioate, (3R*,4S*,5S*,6R*,7R*,9R*,11R*,12R*,13S*,14R*)-4-((2,6-Dideoxy-3-C-methyl-3-O-methyl-alpha-L-ribo-hexopyranosyl)oxy)-14-ethyl-7,12,13-trihydroxy-3,5,7,9,11,13-hexamethyl-6-((2- ethyl butanedioate -3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranosyl)oxy)oxacyclotetradecane-2,10-dione
Bioactivity: -
Solubility in Different Solvents
| Solvent | Temperature [K] | Crystal form | Solubility [mg/mL] | Reference |
|---|---|---|---|---|
| Acetone | 288.15 | - | 166.0 | [208] |
| Acetone | 293.15 | - | 209.5 | [208] |
| Acetone | 298.15 | - | 261.2 | [208] |
| Acetone | 303.15 | - | 318.8 | [208] |
| Acetone | 308.15 | - | 412.3 | [208] |
| Acetone | 313.15 | - | 505.0 | [208] |
| Acetone | 318.15 | - | 629.2 | [208] |
| Acetone | 323.15 | - | 734.7 | [208] |
| Acetonitrile | 288.15 | - | 31.54 | [208] |
| Acetonitrile | 293.15 | - | 41.57 | [208] |
| Acetonitrile | 298.15 | - | 54.35 | [208] |
| Acetonitrile | 303.15 | - | 64.56 | [208] |
| Acetonitrile | 308.15 | - | 81.49 | [208] |
| Acetonitrile | 313.15 | - | 113.1 | [208] |
| Acetonitrile | 318.15 | - | 144.8 | [208] |
| Acetonitrile | 323.15 | - | 182.0 | [208] |
| Ethanol | 288.15 | - | 114.0 | [208] |
| Ethanol | 293.15 | - | 144.1 | [208] |
| Ethanol | 298.15 | - | 190.0 | [208] |
| Ethanol | 303.15 | - | 253.5 | [208] |
| Ethanol | 308.15 | - | 360.6 | [208] |
| Ethanol | 313.15 | - | 482.5 | [208] |
| Ethanol | 318.15 | - | 620.7 | [208] |
| Ethanol | 323.15 | - | 780.2 | [208] |
| Hexane | 288.15 | - | 0.615 | [208] |
| Hexane | 293.15 | - | 0.8497 | [208] |
| Hexane | 298.15 | - | 1.036 | [208] |
| Hexane | 303.15 | - | 1.383 | [208] |
| Hexane | 308.15 | - | 1.85 | [208] |
| Hexane | 313.15 | - | 2.379 | [208] |
| Hexane | 318.15 | - | 3.577 | [208] |
| Hexane | 323.15 | - | 4.414 | [208] |
| Isopropanol | 288.15 | - | 92.99 | [208] |
| Isopropanol | 293.15 | - | 120.8 | [208] |
| Isopropanol | 298.15 | - | 159.8 | [208] |
| Isopropanol | 303.15 | - | 212.6 | [208] |
| Isopropanol | 308.15 | - | 282.8 | [208] |
| Isopropanol | 313.15 | - | 390.8 | [208] |
| Isopropanol | 318.15 | - | 527.0 | [208] |
| Isopropanol | 323.15 | - | 641.6 | [208] |
| Tetrahydrofuran | 288.15 | - | 399.2 | [208] |
| Tetrahydrofuran | 293.15 | - | 461.1 | [208] |
| Tetrahydrofuran | 298.15 | - | 544.6 | [208] |
| Tetrahydrofuran | 303.15 | - | 644.6 | [208] |
| Tetrahydrofuran | 308.15 | - | 764.8 | [208] |
| Tetrahydrofuran | 313.15 | - | 912.3 | [208] |
| Tetrahydrofuran | 318.15 | - | 1112.6 | [208] |
| Tetrahydrofuran | 323.15 | - | 1310.1 | [208] |
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 7484.7336 |
| PMI2 | 20014.6565 |
| PMI3 | 23896.2681 |
| NPR1 | 0.3132 |
| NPR2 | 0.8376 |
| RadiusOfGyration | 5.4598 |
| InertialShapeFactor | 0.0001 |
| Eccentricity | 0.9497 |
| Asphericity | 0.3342 |
| SpherocityIndex | 0.2591 |
| PBF | 1.3980 |