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Etimicin

CAT: 1299-RM-E202100-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-E202100-02Size:25 mg
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CAS Number
59711-96-5
Synonyms
(2R,3R,4R,5R) -2- (((1S,2S,3R,4S,6R) -4-amino-3- (((2R,3R,6S) -3-amino-6- (aminomethyl) tetrahydro-2H-pyran-2-yl) oxy) -6- (ethylamino) -2-hydroxycyclohexyl) oxy) -5-methyl-4- (methylamino) tetrahydro-2H-pyran-3,5-diol
Molecular Formula
C21H43N5O7
Molecular Weight
477.6
Target Alternative Name
Etimicin
Product Name Synonym
(2R,3R,4R,5R) -2- (((1S,2S,3R,4S,6R) -4-amino-3- (((2R,3R,6S) -3-amino-6- (aminomethyl) tetrahydro-2H-pyran-2-yl) oxy) -6- (ethylamino) -2-hydroxycyclohexyl) oxy) -5-methyl-4- (methylamino) tetrahydro-2H-pyran-3,5-diol

Chemical Information

Etimicin

Etimicin is an aminoglycoside antibiotic that is gentamycin C1a in which the hydrogen of the amino group at position 1 is substituted by an ethyl group. It is a fourth generation semisynthetic aminoglycoside that has antimicrobial activity against both gram-positive and gram-negative bacterial infections and also effective against aminoglycoside resistant strains. It has a role as an antibacterial agent. It is an amino cyclitol glycoside and an aminoglycoside antibiotic. It is functionally related to a gentamycin C1a.

CAS Number59711-96-5
PubChem CID9912913
IUPAC Name(2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4-amino-3-[(2R,3R,6S)-3-amino-6-(aminomethyl)oxan-2-yl]oxy-6-(ethylamino)-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol
Molecular FormulaC21H43N5O7
Molecular Weight477.6
XLogP-4.2
Topological Polar Surface Area200
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count12
Rotatable Bond Count8
Heavy Atom Count33
Formal Charge0
Complexity622
SMILES
CCN[C@@H]1C[C@@H]([C@H]([C@@H]([C@H]1O[C@@H]2[C@@H]([C@H]([C@@](CO2)(C)O)NC)O)O)O[C@@H]3[C@@H](CC[C@H](O3)CN)N)N
InChI
InChI=1S/C21H43N5O7/c1-4-26-13-7-12(24)16(32-19-11(23)6-5-10(8-22)31-19)14(27)17(13)33-20-15(28)18(25-3)21(2,29)9-30-20/h10-20,25-29H,4-9,22-24H2,1-3H3/t10-,11+,12-,13+,14-,15+,16+,17-,18+,19+,20+,21-/m0/s1
InChIKey
NZGMVSJQULXLHF-RAKCNUBFSA-N
Chemical Structure
2D Structure
2D structure of Etimicin
CAS: 59711-96-5
CID: 9912913
Formula: C21H43N5O7
MW: 477.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight477.6
XLogP3-4.2
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count12
Rotatable Bond Count8
Exact Mass477.31624873
Monoisotopic Mass477.31624873
Topological Polar Surface Area200 Ų
Heavy Atom Count33
Formal Charge0
Complexity622
Isotope Atom Count0
Defined Atom Stereocenter Count12
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
AR-E10680-01Etimicin Sulphate
HY-B0755-01Etimicin (sulfate)
GTR19220528-01Etimicin sulfate
AR-E10681-01Etimicin Impurity 1
AR-E10689-01Etimicin-D5
AR-E10687-01Etimicin Impurity 7
AR-E10686-01Etimicin Impurity 6
AR-E10685-01Etimicin Impurity 5
AR-E10684-01Etimicin Impurity 4
AR-E10683-01Etimicin Impurity 3

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