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Neosalvianen

CAT: 0013-GTR19164702-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19164702-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Neosalvianen is a bioactive small molecule compound derived from the medicinal plant Salvia miltiorrhiza. It is utilized in biochemical research for in vitro studies exploring its potential mechanisms and pharmacological activities.
CAS Number
790673-00-6
Product Name Alternative
Neosalvianen
Purity
99.09% (May vary between batches)
Solubility
DMSO:Insoluble
Smiles
CC=1OC=2C3=C (C4=C (C2N1) C (C) =CO4) C=CC5=C3CCCC5 (C) C
Molecular Formula
C21H21NO2
Molecular Weight
319.4
Storage Conditions
Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

Neosalvianen
CAS Number790673-00-6
PubChem CID11472648
IUPAC Name5,9,17,17-tetramethyl-3,10-dioxa-8-azapentacyclo[10.8.0.02,6.07,11.013,18]icosa-1(12),2(6),4,7(11),8,13(18),19-heptaene
Molecular FormulaC21H21NO2
Molecular Weight319.4
XLogP5.5
Topological Polar Surface Area39.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count24
Formal Charge0
Complexity506
SMILES
CC1=COC2=C1C3=C(C4=C2C=CC5=C4CCCC5(C)C)OC(=N3)C
InChI
InChI=1S/C21H21NO2/c1-11-10-23-19-14-7-8-15-13(6-5-9-21(15,3)4)17(14)20-18(16(11)19)22-12(2)24-20/h7-8,10H,5-6,9H2,1-4H3
InChIKey
XIEAHUZPQQITDN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Neosalvianen
CAS: 790673-00-6
CID: 11472648
Formula: C21H21NO2
MW: 319.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight319.4
XLogP35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass319.157228913
Monoisotopic Mass319.157228913
Topological Polar Surface Area39.2 Ų
Heavy Atom Count24
Formal Charge0
Complexity506
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
380932Neosalvianen

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