mycophenolate mofetil impurity standard
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- structure.search.product.name mycophenolate mofetil impurity standard
- Product Code: BP 1255
- Brand: BP
Product Overview
Product Code
BP 1255
CAS Number
5 AnalytesProduct Format
Mixture
API Family
Mycophenolate MofetilProduct Categories
Product Information
Analyte Data
Analyte Name
Measured Value
CAS Number
Molecular Structure
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2-(Morpholin-4-yl)ethyl (4E)-6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydroisobenzofuran-5-yl)-4-methylhex-4-enoate N-Oxide
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2-morpholin-4-ylethyl 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
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O-Desmethyl Mycophenolate Mofetil(Impurity A)
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CAS Number
Alternate CAS Number
Unlabelled CAS Number
Molecular Formula
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Molecular Weight
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Accurate Mass
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Melting Point
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Appearance/Form
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SMILES
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InChI
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IUPAC
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2-(Morpholin-4-yl)ethyl (4E)-6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydroisobenzofuran-5-yl)-4-methylhex-4-enoate N-Oxide
CAS Number
Alternate CAS Number
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Unlabelled CAS Number
-
Molecular Formula
C23 H31 N O8
Molecular Weight
449.49
Accurate Mass
449.205
SMILES
COc1c(C)c2COC(=O)c2c(O)c1C\C=C(/C)\CCC(=O)OCC[N+]3([O-])CCOCC3
InChI
InChI=1S/C23H31NO8/c1-15(5-7-19(25)31-13-10-24(28)8-11-30-12-9-24)4-6-17-21(26)20-18(14-32-23(20)27)16(2)22(17)29-3/h4,26H,5-14H2,1-3H3/b15-4+
IUPAC
2-(4-oxidomorpholin-4-ium-4-yl)ethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
2-morpholin-4-ylethyl 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C23 H31 N O7
Molecular Weight
433.4947
Accurate Mass
433.2101
SMILES
COc1c(C)c2COC(=O)c2c(O)c1CC=C(C)CCC(=O)OCCN3CCOCC3
InChI
InChI=1S/C23H31NO7/c1-15(5-7-19(25)30-13-10-24-8-11-29-12-9-24)4-6-17-21(26)20-18(14-31-23(20)27)16(2)22(17)28-3/h4,26H,5-14H2,1-3H3
IUPAC
2-morpholin-4-ylethyl 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
Mycophenolate Mofetil
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C23 H31 N O7
Molecular Weight
433.49
Accurate Mass
433.2101
SMILES
COc1c(C)c2COC(=O)c2c(O)c1C\C=C(/C)\CCC(=O)OCCN3CCOCC3
InChI
InChI=1S/C23H31NO7/c1-15(5-7-19(25)30-13-10-24-8-11-29-12-9-24)4-6-17-21(26)20-18(14-31-23(20)27)16(2)22(17)28-3/h4,26H,5-14H2,1-3H3/b15-4+
IUPAC
2-morpholin-4-ylethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
Mycophenolic acid
CAS Number
Alternate CAS Number
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Unlabelled CAS Number
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Molecular Formula
C17 H20 O6
Molecular Weight
320.34
Accurate Mass
320.126
SMILES
COc1c(C)c2COC(=O)c2c(O)c1C\C=C(/C)\CCC(=O)O
InChI
InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+
IUPAC
(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid
O-Desmethyl Mycophenolate Mofetil(Impurity A)
CAS Number
Alternate CAS Number
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Unlabelled CAS Number
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Molecular Formula
C22H29NO7
Molecular Weight
419.47
Accurate Mass
-
SMILES
C\C(=C/Cc1c(O)c(C)c2COC(=O)c2c1O)\CCC(=O)OCCN3CCOCC3
Product Data
Storage Temperature
-20°C
Shipping Temperature
Ice pack (-20°C)
Country of Origin
FRANCE
Product Format
Mixture
API Family