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5-TAMRA Cadaverine

CAT: 0931-T69315-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T69315-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
383912-87-6
Target
Others
Related Pathways
Others
Bioactivity
5-TAMRA cadaverine can used to modify carboxylic acid group in the presence of activators (e.g. EDC, or DCC) or activated esters (e.g. NHS esters) through a stable amide bond.
Smiles
C([O-])(=O)C1=C(C=2C3=C([O+]=C4C2C=CC(N(C)C)=C4)C=C(N(C)C)C=C3)C=CC(C(NCCCCCN)=O)=C1
Molecular Formula
C30H34N4O4
Molecular Weight
514.62
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5-TAMRA cadaverine
CAS Number383912-87-6
PubChem CID60078939
IUPAC Name5-(5-aminopentylcarbamoyl)-2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]benzoate
Molecular FormulaC30H34N4O4
Molecular Weight514.6
XLogP0.8
Topological Polar Surface Area111
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count38
Formal Charge0
Complexity974
SMILES
CN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3O2)C4=C(C=C(C=C4)C(=O)NCCCCCN)C(=O)[O-]
InChI
InChI=1S/C30H34N4O4/c1-33(2)20-9-12-23-26(17-20)38-27-18-21(34(3)4)10-13-24(27)28(23)22-11-8-19(16-25(22)30(36)37)29(35)32-15-7-5-6-14-31/h8-13,16-18H,5-7,14-15,31H2,1-4H3,(H-,32,35,36,37)
InChIKey
GGMFTOCYWNYUSU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-TAMRA cadaverine
CAS: 383912-87-6
CID: 60078939
Formula: C30H34N4O4
MW: 514.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight514.6
XLogP30.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass514.25800558
Monoisotopic Mass514.25800558
Topological Polar Surface Area111 Ų
Heavy Atom Count38
Formal Charge0
Complexity974
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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