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Mometasone Furoate EP Impurity E

CAT: 1596-AR-M02173-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-M02173-01Size:10 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1370190-33-2
Synonyms
(11β,16α) -9,21-Dichloro-11,17-bis[ (2-furanylcarbonyl) oxy]-16-methyl-pregna-1,4- diene-3,20-dione; 11,17-Difuroate Mometasone Furoate; Mometasone EP Impurity E
Molecular Formula
C32H32Cl2O8
Molecular Weight
615.50
API Name
Mometasone

Chemical Information

Mometasone Furoate EP Impurity E
CAS Number1370190-33-2
PubChem CID99564855
IUPAC Name[(8S,9R,10S,11S,13S,14S,16R,17R)-9-chloro-17-(2-chloroacetyl)-17-(furan-2-carbonyloxy)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-11-yl] furan-2-carboxylate
Molecular FormulaC32H32Cl2O8
Molecular Weight615.5
XLogP5.5
Topological Polar Surface Area113
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Heavy Atom Count42
Formal Charge0
Complexity1250
SMILES
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CCl)OC(=O)C5=CC=CO5)C)OC(=O)C6=CC=CO6)Cl)C
InChI
InChI=1S/C32H32Cl2O8/c1-18-14-22-21-9-8-19-15-20(35)10-11-29(19,2)31(21,34)26(41-27(37)23-6-4-12-39-23)16-30(22,3)32(18,25(36)17-33)42-28(38)24-7-5-13-40-24/h4-7,10-13,15,18,21-22,26H,8-9,14,16-17H2,1-3H3/t18-,21+,22+,26+,29+,30+,31+,32+/m1/s1
InChIKey
MJDGUHJEIVTMQZ-VYYCQGSCSA-N
Chemical Structure
2D Structure
2D structure of Mometasone Furoate EP Impurity E
CAS: 1370190-33-2
CID: 99564855
Formula: C32H32Cl2O8
MW: 615.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight615.5
XLogP35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Exact Mass614.1474234
Monoisotopic Mass614.1474234
Topological Polar Surface Area113 Ų
Heavy Atom Count42
Formal Charge0
Complexity1250
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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