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AP219

CAT: 0931-T36240-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T36240-04Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
779282-36-9
Target
Others, Endogenous Metabolite
Related Pathways
Metabolism, Others
Bioactivity
AP39 is a compound used to increase hydrogen sulfide (H2S) levels within mitochondria; it consists of a mitochondria-targeting motif (triphenylphosphonium) coupled to an H2S-donating moiety (dithiolethione) by an aliphatic linker. AP219, as a control compound for AP39, contains the triphenylphosphonium scaffold but lacks the H2S-releasing portion.
Smiles
OC(=O)CCCCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1
Molecular Formula
C28H34O2P
Molecular Weight
433.551
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(9-Carboxynonyl)triphenylphosphonium
CAS Number779282-36-9
PubChem CID18795072
IUPAC Name9-carboxynonyl(triphenyl)phosphanium
Molecular FormulaC28H34O2P+
Molecular Weight433.5
XLogP7.4
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count13
Heavy Atom Count31
Formal Charge1
Complexity442
SMILES
C1=CC=C(C=C1)[P+](CCCCCCCCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C28H33O2P/c29-28(30)23-15-4-2-1-3-5-16-24-31(25-17-9-6-10-18-25,26-19-11-7-12-20-26)27-21-13-8-14-22-27/h6-14,17-22H,1-5,15-16,23-24H2/p+1
InChIKey
VOOZXZVXPXRBBF-UHFFFAOYSA-O
Chemical Structure
2D Structure
2D structure of (9-Carboxynonyl)triphenylphosphonium
CAS: 779282-36-9
CID: 18795072
Formula: C28H34O2P+
MW: 433.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight433.5
XLogP37.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count13
Exact Mass433.22964232
Monoisotopic Mass433.22964232
Topological Polar Surface Area37.3 Ų
Heavy Atom Count31
Formal Charge1
Complexity442
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

Alternative Products

CatalogName
MBS5797418AP219
H-AP219H-AP219 primer

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