Products for Research Use Only

MAO-A/SERT-IN-1

CAT: 0013-GTR19239111-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19239111-01Size:25 mg
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Description
MAO-A/SERT-IN-1 is a dual inhibitor of monoamine oxidase A and the serotonin transporter, reducing 5-HT reuptake. It exhibits neuroprotective effects in vitro and has been shown to reduce depressive-like behaviors in zebrafish and mouse models, supporting its use in neuropsychiatric research.
CAS Number
3001361-38-9
Field of Research
Neuroscience, Neuroscience; Metabolism Research
Smiles
O=[N+] (OCCCOC1=CC (C (C2=C (C3=NC=C4) C=CC=C2) =O) =C3C4=C1) [O-]
Molecular Formula
C19H14N2O5
Molecular Weight
350.32
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Mao-A/sert-IN-1
CAS Number3001361-38-9
PubChem CID172638558
IUPAC Name3-[(8-oxo-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-11-yl)oxy]propyl nitrate
Molecular FormulaC19H14N2O5
Molecular Weight350.3
XLogP3.9
Topological Polar Surface Area94.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity537
SMILES
C1=CC=C2C(=C1)C3=NC=CC4=CC(=CC(=C43)C2=O)OCCCO[N+](=O)[O-]
InChI
InChI=1S/C19H14N2O5/c22-19-15-5-2-1-4-14(15)18-17-12(6-7-20-18)10-13(11-16(17)19)25-8-3-9-26-21(23)24/h1-2,4-7,10-11H,3,8-9H2
InChIKey
RTKGLCAGYHBBKS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mao-A/sert-IN-1
CAS: 3001361-38-9
CID: 172638558
Formula: C19H14N2O5
MW: 350.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight350.3
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass350.09027155
Monoisotopic Mass350.09027155
Topological Polar Surface Area94.2 Ų
Heavy Atom Count26
Formal Charge0
Complexity537
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