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Salinomycin

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Name

Salinomycin

EINECS 258-290-1
CAS No. 53003-10-4 Density 1.18 g/cm3
PSA 164.04000 LogP 4.85330
Solubility Soluble in ethanol Melting Point 112.5-113.5 °C
Formula C42H70O11 Boiling Point 839.2 °C at 760 mmHg
Molecular Weight 751.011 Flash Point 243.2 °C
Transport Information UN 3462 6.1/PG 2 Appearance white or light yellow crystalline powder
Safety 45-36-26 Risk Codes 25-36/37/38
Molecular Structure Molecular Structure of 53003-10-4 (Salinomycin) Hazard Symbols ToxicT,IrritantXi
Synonyms

Antibiotic 61477;Coxistac;Stereoisomer of a-ethyl-6-[5-[2-(5-ethyltetrahydro-5-hydroxy-6-methyl-2H-pyran-2-yl)-15-hydroxy-2,10,12-trimethyl-1,6,8-trioxadispiro[4.1.5.3]pentadec-13-en-9-yl]-2-hydroxy-1,3-dimethyl-4-oxoheptyl]tetrahydro-5-methyl-2H-pyran-2-aceticacid;Salinomicina;

Article Data 10

Salinomycin Specification

The IUPAC name of Salinomycin is (2R)-2-[(2R,5S,6R)-6-[(2S,3S,4S,6R)-6-[(3S,5S,7R,9S,10S,12R,15R)-3-[(2R,5R,6S)-5-ethyl-5-hydroxy-6-methyloxan-2-yl]-15-hydroxy-3,10,12-trimethyl-4,6,8-trioxadispiro[4.1.57.35]pentadec-13-en-9-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-5-methyloxan-2-yl]butanoic acid. With the CAS registry number 53003-10-4, it is also named as Coxistac. The product's categories are Interferes with Cell Membrane Permeability (Ionophores)Voltage-gated Ion Channels; Ionophores Spectrum of Activity; Antibacterial; Antibiotics; Antibiotics A to; Antibiotics N-S Antibiotics; Chemical Structure Class; L - Z Antibiotics; Mechanism of Action; Monovalent Ion Channels; Polyethers. Besides, it is white or light yellow crystalline powder, which should be stored at 2-8 °C. It is stable, but incompatible with strong oxidizing agents. In addition, its molecular formula is C42H70O11 and molecular weight is 751.01.

The other characteristics of this product can be summarized as: (1)EINECS: 258-290-1; (2)ACD/LogP: 6.10; (3)# of Rule of 5 Violations: 3; (4)ACD/LogD (pH 5.5): 4.93; (5)ACD/LogD (pH 7.4): 3.14; (6)ACD/BCF (pH 5.5): 1732.24; (7)ACD/BCF (pH 7.4): 27.83; (8)ACD/KOC (pH 5.5): 3375.29; (9)ACD/KOC (pH 7.4): 54.24; (10)#H bond acceptors: 11; (11)#H bond donors: 4; (12)#Freely Rotating Bonds: 15; (13)Index of Refraction: 1.547; (14)Molar Refractivity: 201.02 cm3; (15)Molar Volume: 633.5 cm3; (16)Surface Tension: 50.5 dyne/cm; (17)Density: 1.18 g/cm3; (18)Flash Point: 243.2 °C; (19)Melting Point: 112.5-113.5 °C; (20)Enthalpy of Vaporization: 138.71 kJ/mol; (21)Boiling Point: 839.2 °C at 760 mmHg; (22)Vapour Pressure: 1.04E-32 mmHg at 25 °C.

Preparation and Uses of Salinomycin: this chemical can be prepared by the fermentation of Streptomyces albus. Additionally, it is an antibacterial and coccidiostat ionophore therapeutic drug. It is also used in chicken fodder as a coccidiostat.

When you are using this chemical, please be cautious about it as the following: it is irritating to eyes, respiratory system and skin. It is also toxic if swallowed. In case of contact with eyes, please rinse immediately with plenty of water and seek medical advice. And you should wear suitable protective clothing. Moreover, in case of accident or if you feel unwell, please seek medical advice immediately (show label where possible).

People can use the following data to convert to the molecule structure.
(1)SMILES: O=C(O)[C@H](CC)[C@@H]1O[C@H]([C@@H](C)CC1)[C@@H](C)[C@H](O)[C@@H](C(=O)[C@@H]([C@H]5O[C@@]/4(O[C@]3(O[C@](C)([C@@H]2O[C@@H](C)[C@@](O)(CC)CC2)CC3)[C@H](O)\C=C\4)[C@@H](C[C@@H]5C)C)CC)C
(2)InChI: InChI=1/C42H70O11/c1-11-29(38(46)47)31-15-14-23(4)36(50-31)27(8)34(44)26(7)35(45)30(12-2)37-24(5)22-25(6)41(51-37)19-16-32(43)42(53-41)21-20-39(10,52-42)33-17-18-40(48,13-3)28(9)49-33/h16,19,23-34,36-37,43-44,48H,11-15,17-18,20-22H2,1-10H3,(H,46,47)/t23-,24-,25+,26-,27-,28-,29+,30-,31+,32+,33+,34+,36+,37-,39-,40+,41-,42-/m0/s1
(3)InChIKey: KQXDHUJYNAXLNZ-XQSDOZFQBR

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 7mg/kg (7mg/kg)   Journal of Antibiotics. Vol. 31, Pg. 1, 1978.
mouse LD50 oral 50mg/kg (50mg/kg)   "Antibiotics: Origin, Nature, and Properties," Korzyoski, T., et al., eds., Washington, DC, American Soc. for Microbiology, 1978Vol. 1, Pg. 813, 1978.

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