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Bima SA

CAT: 0931-T84556-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T84556-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1175838-84-2
Target
Others, Prostaglandin Receptor
Related Pathways
Immunology/Inflammation, GPCR/G Protein, Others
Bioactivity
Bimatoprost Serinol Amide (Bima SA), a prostaglandin analog, shows research potential for glaucoma [1].
Smiles
C(/C=C\CCCC(NC(CO)CO)=O)[C@@H]1[C@@H](/C=C/[C@H](CCC2=CC=CC=C2)O)[C@H](O)C[C@@H]1O
Molecular Formula
C26H39NO6
Molecular Weight
461.59
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

17-phenyl trinor Prostaglandin F2alpha serinol amide
CAS Number1175838-84-2
PubChem CID35026314
IUPAC Name(Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxy-5-phenylpent-1-enyl]cyclopentyl]-N-(1,3-dihydroxypropan-2-yl)hept-5-enamide
Molecular FormulaC26H39NO6
Molecular Weight461.6
XLogP1.1
Topological Polar Surface Area130
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count6
Rotatable Bond Count14
Heavy Atom Count33
Formal Charge0
Complexity600
SMILES
C1[C@@H]([C@@H]([C@H]([C@@H]1O)/C=C/[C@H](CCC2=CC=CC=C2)O)C/C=C\CCCC(=O)NC(CO)CO)O
InChI
InChI=1S/C26H39NO6/c28-17-20(18-29)27-26(33)11-7-2-1-6-10-22-23(25(32)16-24(22)31)15-14-21(30)13-12-19-8-4-3-5-9-19/h1,3-6,8-9,14-15,20-25,28-32H,2,7,10-13,16-18H2,(H,27,33)/b6-1-,15-14+/t21-,22+,23+,24-,25+/m0/s1
InChIKey
FQGNKSXLEDAGFC-LSLURRSKSA-N
Chemical Structure
2D Structure
2D structure of 17-phenyl trinor Prostaglandin F2alpha serinol amide
CAS: 1175838-84-2
CID: 35026314
Formula: C26H39NO6
MW: 461.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight461.6
XLogP31.1
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count6
Rotatable Bond Count14
Exact Mass461.27773796
Monoisotopic Mass461.27773796
Topological Polar Surface Area130 Ų
Heavy Atom Count33
Formal Charge0
Complexity600
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes