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Erythromycin thiocyanate

CAT: 0931-T11233-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T11233-02Size:50 mg
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CAS Number
7704-67-8
Target
DNA/RNA Synthesis, Antibiotic, Antibacterial
Related Pathways
DNA Damage/DNA Repair, Microbiology/Virology, Cell Cycle/Checkpoint
Bioactivity
Erythromycin thiocyanate acts by binding to bacterial 50S ribosomal subunits and inhibits RNA-dependent protein synthesis by blockage of transpeptidation and/or translocation reactions, without affecting synthesis of nucleic acid .Erythromycin thiocyanate is a macrolide antibiotic produced by actinomycete Streptomyces erythreus with a broad spectrum of antimicrobial activity.
Smiles
SC#N.[H][C@@]1(C[C@@](C)(OC)[C@@H](O)[C@H](C)O1)O[C@H]1[C@H](C)[C@@H](O[C@]2([H])O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]1C
Molecular Formula
C38H68N2O13S
Molecular Weight
793.02
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Erythromycin Thiocyanate
CAS Number7704-67-8
PubChem CID83938
IUPAC Name(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-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-oxacyclotetradecane-2,10-dione;thiocyanic acid
Molecular FormulaC38H68N2O13S
Molecular Weight793.0
Topological Polar Surface Area219
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count16
Rotatable Bond Count7
Heavy Atom Count54
Formal Charge0
Complexity1210
SMILES
CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O.C(#N)S
InChI
InChI=1S/C37H67NO13.CHNS/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26;2-1-3/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3;3H/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-;/m1./s1
InChIKey
WVRRTEYLDPNZHR-YZPBMOCRSA-N
Chemical Structure
2D Structure
2D structure of Erythromycin Thiocyanate
CAS: 7704-67-8
CID: 83938
Formula: C38H68N2O13S
MW: 793.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight793.0
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count16
Rotatable Bond Count7
Exact Mass792.44421140
Monoisotopic Mass792.44421140
Topological Polar Surface Area219 Ų
Heavy Atom Count54
Formal Charge0
Complexity1210
Isotope Atom Count0
Defined Atom Stereocenter Count18
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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T31356Decyl thiocyanate
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Alternative Products

CatalogName
TRC-E650055-100GErythromycin Thiocyanate
HY-B0220D-01Erythromycin (thiocyanate)
HY-B0220DRErythromycin (thiocyanate) (Standard)
AR-E01825-01Erythromycin A 9-Oxime Thiocyanate
B1939-5000Erythromycin

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