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CAY10737

CAT: 0013-GTR19190989-01Size: 500 µgDry Ice: NoHazardous: No
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CAT#:0013-GTR19190989-01Size:500 µg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
CAY10737 is a selective turn-on fluorescent probe for carbon monoxide detection via a Pd-mediated Tsuji-Trost reaction, yielding a fluorophore with 678/714 nm emission. Its low cytotoxicity enables application in monitoring CO production in both live-cell (in vitro) and animal (in vivo) models for research in gasotransmitter biology and related diseases.
CAS Number
2079118-42-4
Smiles
C[N+]1=C (C=CC2=C3Oc4cc (OC (=O) OCC=C) ccc4C=C3CCC2) C (C) (C) c2ccccc12 |w:4.4, c:1,5,22|
Molecular Formula
C30H30NO4
Molecular Weight
468.572
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

prop-2-enyl [5-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]-7,8-dihydro-6H-xanthen-3-yl] carbonate
CAS Number2079118-42-4
PubChem CID132570089
IUPAC Nameprop-2-enyl [5-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]-7,8-dihydro-6H-xanthen-3-yl] carbonate
Molecular FormulaC30H30NO4+
Molecular Weight468.6
XLogP5.9
Topological Polar Surface Area47.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count35
Formal Charge1
Complexity984
SMILES
CC1(C2=CC=CC=C2[N+](=C1/C=C/C3=C4C(=CC5=C(O4)C=C(C=C5)OC(=O)OCC=C)CCC3)C)C
InChI
InChI=1S/C30H30NO4/c1-5-17-33-29(32)34-23-15-13-21-18-22-10-8-9-20(28(22)35-26(21)19-23)14-16-27-30(2,3)24-11-6-7-12-25(24)31(27)4/h5-7,11-16,18-19H,1,8-10,17H2,2-4H3/q+1/b16-14+
InChIKey
JRXRMPWUNYRPST-JQIJEIRASA-N
Chemical Structure
2D Structure
2D structure of prop-2-enyl [5-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]-7,8-dihydro-6H-xanthen-3-yl] carbonate
CAS: 2079118-42-4
CID: 132570089
Formula: C30H30NO4+
MW: 468.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight468.6
XLogP35.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass468.21748344
Monoisotopic Mass468.21748344
Topological Polar Surface Area47.8 Ų
Heavy Atom Count35
Formal Charge1
Complexity984
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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