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Fusidic Acid Impurity 19

CAT: 1299-RM-F211919-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-F211919-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2802408-15-5
Synonyms
(2Z) -2- ((3R,4S,5S,8S,9S,10S,11R,13R,14S,16S) -16-acetoxy-3,11-dihydroxy-4,8,10,14-tetramethylhexadecahydro-17H-cyclopenta[a]phenanthren-17-ylidene) -7-hydroxy-6-methylhept-5-enoic acid
Molecular Formula
C31H48O7
Molecular Weight
532.72
Target Alternative Name
Fusidic Acid
Product Name Synonym
(2Z) -2- ((3R,4S,5S,8S,9S,10S,11R,13R,14S,16S) -16-acetoxy-3,11-dihydroxy-4,8,10,14-tetramethylhexadecahydro-17H-cyclopenta[a]phenanthren-17-ylidene) -7-hydroxy-6-methylhept-5-enoic acid

Chemical Information

26-Hydroxy-fusidic Acid
CAS Number2802408-15-5
PubChem CID122384392
IUPAC Name(E,2Z)-2-[(3R,4S,5S,8S,9S,10S,11R,13R,14S,16S)-16-acetyloxy-3,11-dihydroxy-4,8,10,14-tetramethyl-2,3,4,5,6,7,9,11,12,13,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ylidene]-7-hydroxy-6-methylhept-5-enoic acid
Molecular FormulaC31H48O7
Molecular Weight532.7
XLogP4.3
Topological Polar Surface Area124
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count38
Formal Charge0
Complexity1020
SMILES
C[C@H]1[C@@H]2CC[C@]3([C@H]([C@]2(CC[C@H]1O)C)[C@@H](C[C@@H]\4[C@@]3(C[C@@H](/C4=C(/CC/C=C(\C)/CO)\C(=O)O)OC(=O)C)C)O)C
InChI
InChI=1S/C31H48O7/c1-17(16-32)8-7-9-20(28(36)37)26-22-14-24(35)27-29(4)12-11-23(34)18(2)21(29)10-13-30(27,5)31(22,6)15-25(26)38-19(3)33/h8,18,21-25,27,32,34-35H,7,9-16H2,1-6H3,(H,36,37)/b17-8+,26-20-/t18-,21-,22-,23+,24+,25-,27-,29-,30-,31-/m0/s1
InChIKey
FLMRNAGUOJGEDM-CEDPPNKGSA-N
Chemical Structure
2D Structure
2D structure of 26-Hydroxy-fusidic Acid
CAS: 2802408-15-5
CID: 122384392
Formula: C31H48O7
MW: 532.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight532.7
XLogP34.3
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass532.34000387
Monoisotopic Mass532.34000387
Topological Polar Surface Area124 Ų
Heavy Atom Count38
Formal Charge0
Complexity1020
Isotope Atom Count0
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

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AR-F02234-01Fusidic Acid EP Impurity H (11-Keto Fusidic Acid)
AR-F02233-01Fusidic Acid EP Impurity G (3-Keto Fusidic Acid)
IF181230-01Fusidic acid EP Impurity C
AF23629-01Fusidic acid
F005-1GFusidic acid sodium
HY-177699Fusidic acid prodrug
HY-B1350R-01Fusidic acid (Standard)

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