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Azithromycin EP Impurity P

CAT: 1596-AR-A13994-01Size: 50 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-A13994-01Size:50 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
92594-45-1
Synonyms
[2R- (2R*,3S*,4R*,5R*,8R*,10R*,11R*,12S*,13S*,14R*) ]-13-[ (2,6-Dideoxy-3-C-methyl-3-O-methyl-?-L-ribo-hexopyranosyl) oxy]-2,6-diethyl-3,4,10-trihydroxy-3,5,8,10,12,14-hexamethyl-11-[[3,4,6-trideoxy-3- (dimethylamino) -?-D-xylo-hexopyranosyl]oxy]-1-oxa-6-azacyclopentadecan-15-one; Azithromycin N-ethyl
Molecular Formula
C39H74N2O12
Molecular Weight
763.01
API Name
Azithromycin

Chemical Information

Azithromycin N-Ethyl
CAS Number92594-45-1
PubChem CID14163765
IUPAC Name11-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2,6-diethyl-3,4,10-trihydroxy-13-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,8,10,12,14-hexamethyl-1-oxa-6-azacyclopentadecan-15-one
Molecular FormulaC39H74N2O12
Molecular Weight763.0
XLogP4.4
Topological Polar Surface Area180
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count14
Rotatable Bond Count8
Heavy Atom Count53
Formal Charge0
Complexity1170
SMILES
CCC1C(C(C(N(CC(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)CC)C)O)(C)O
InChI
InChI=1S/C39H74N2O12/c1-15-28-39(11,47)32(43)25(7)41(16-2)20-21(3)18-37(9,46)34(53-36-30(42)27(40(12)13)17-22(4)49-36)23(5)31(24(6)35(45)51-28)52-29-19-38(10,48-14)33(44)26(8)50-29/h21-34,36,42-44,46-47H,15-20H2,1-14H3
InChIKey
MGXWHWVRHQDUNK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Azithromycin N-Ethyl
CAS: 92594-45-1
CID: 14163765
Formula: C39H74N2O12
MW: 763.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight763.0
XLogP34.4
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count14
Rotatable Bond Count8
Exact Mass762.52417580
Monoisotopic Mass762.52417580
Topological Polar Surface Area180 Ų
Heavy Atom Count53
Formal Charge0
Complexity1170
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count18
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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