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(+/-) -tetrahydropalmatine

CAT: 0957-S5559-25mgSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0957-S5559-25mgSize:25 mg
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CAS Number
2934-97-6
Target
Dopamine Receptor
Applications
Neuronal Signaling
Molecular Formula
C21H25NO4
Additionnal Information
(+/-) -tetrahydropalmatine, a plant alkaloid used as an ingredient in dietary supplement products, is a potent and selective D1 receptor antagonist.
Storage Conditions
3 years -20°C powder

Chemical Information

Rotundine

2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline is an alkaloid.

CAS Number2934-97-6
PubChem CID5417
IUPAC Name2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
Molecular FormulaC21H25NO4
Molecular Weight355.4
XLogP3.2
Topological Polar Surface Area40.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity475
SMILES
COC1=C(C2=C(CC3C4=CC(=C(C=C4CCN3C2)OC)OC)C=C1)OC
InChI
InChI=1S/C21H25NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,10-11,17H,7-9,12H2,1-4H3
InChIKey
AEQDJSLRWYMAQI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Rotundine
CAS: 2934-97-6
CID: 5417
Formula: C21H25NO4
MW: 355.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight355.4
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass355.17835828
Monoisotopic Mass355.17835828
Topological Polar Surface Area40.2 Ų
Heavy Atom Count26
Formal Charge0
Complexity475
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes