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Tetrandrine

CAT: 0013-GTR19171263-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19171263-01Size:100 mg
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Description
Tetrandrine is a natural bisbenzylisoquinoline alkaloid that acts as a calcium channel blocker, inhibiting both voltage-gated calcium channels and Ca2+-activated potassium channels. It is widely used in pharmacological research, including in vitro ion channel studies and in vivo models for investigating cardiovascular and anti-inflammatory pathways.
CAS Number
518-34-3
Product Name Alternative
Ca2+ channels, Calcium Channel, Ca channels, d-Tetrandrine, CalciumChannel, Inhibitor, Fanchinine, Hanfangchin A, KcsA, inhibit, NSC 77037, NSC77037, NSC-77037, Tetrandrine, Potassium Channel, PotassiumChannel, Sinomenine A
Field of Research
Infectious Disease & Virology, Metabolism Research, Pharmacology & Drug Discovery
Purity
98.88% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:0.7 mg/mL (1.12 mM) ; DMSO:12.45 mg/mL (19.99 mM)
Smiles
O (C) C1=C2C=3[C@] (CC=4C=C (C (OC) =CC4) OC=5C=CC (C[C@]6 (C7=CC (O2) =C (OC) C=C7CCN6C) [H]) =CC5) (N (C) CCC3C=C1OC) [H]
Molecular Formula
C38H42N2O6
Molecular Weight
622.75
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Tetrandrine

(+)-Tetrandrine is a bisbenzylisoquinoline alkaloid and a member of isoquinolines.

CAS Number518-34-3
PubChem CID73078
IUPAC Name(1S,14S)-9,20,21,25-tetramethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaene
Molecular FormulaC38H42N2O6
Molecular Weight622.7
XLogP6.4
Topological Polar Surface Area61.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count46
Formal Charge0
Complexity979
SMILES
CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)C[C@H]6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)OC)OC
InChI
InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30-/m0/s1
InChIKey
WVTKBKWTSCPRNU-KYJUHHDHSA-N
Chemical Structure
2D Structure
2D structure of Tetrandrine
CAS: 518-34-3
CID: 73078
Formula: C38H42N2O6
MW: 622.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight622.7
XLogP36.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass622.30428706
Monoisotopic Mass622.30428706
Topological Polar Surface Area61.9 Ų
Heavy Atom Count46
Formal Charge0
Complexity979
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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