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Chemical structure of Sulfo-Cy3(Me)COOH

GC71747

Sulfo-Cy3(Me)COOH

Also known as 2-[3-[1-(5-carboxypentyl)-3,3-dimethyl-5-sulfoindol-2-ylidene]prop-1-enyl]-1,3,3-trimethylindol-1-ium-5-sulfonate

Sulfo-Cy3(Me)COOH is a sulfo-Cyanine3 derivative

ChemicalCAS1121756-11-3MW616.75FormulaC30H36N2O8S2
CAS number
1121756-11-3
Molecular weight
616.75
Formula
C30H36N2O8S2
Solubility
H2O ： 125 mg/mL (202·68 mM; Need ultrasonic)
InChIKey
DGUNPJFECVJMDZ-UHFFFAOYSA-N
Catalogue number
GC71747
Brand
GLPBIO
Computed properties PubChem CID 131637539 · XLogP 3.6 · TPSA 172 Ų · H-bond donors 2
XLogP
3.6
TPSA
172 Ų
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
9
Heavy atoms
42

SMILES CC1(C2=C(C=CC(=C2)S(=O)(=O)[O-])[N+](=C1C=CC=C3C(C4=C(N3CCCCCC(=O)O)C=CC(=C4)S(=O)(=O)O)(C)C)C)C

Computed descriptors from PubChem (CID 131637539), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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