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Norfluorocurarine

CAT: 0804-HY-N3178Size: InquireDry Ice: NoHazardous: No
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CAT#:0804-HY-N3178Size:Inquire
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CAS Number
6880-54-2
UNSPSC Description
Norfluorocurarine (C-Norcurarine III) is a flavonoid product that can be isolated from Andrographis paniculata[1].
Target Antigen
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/norfluorocurarine.html
Smiles
O=CC1=C2[C@]3(C4=CC=CC=C4N2)[C@]5([H])C[C@@]1([H])/C(CN5CC3)=C\C
Molecular Weight
292.37
Shipping Conditions
Room temperature
Clinical Information
No Development Reported

Chemical Information

Norfluorocurarine

(1R,11S,12E,17S)-12-ethylidene-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6,9-tetraene-10-carbaldehyde has been reported in Tabernaemontana eglandulosa, Strychnos ngouniensis, and other organisms with data available.

CAS Number6880-54-2
PubChem CID5581319
IUPAC Name(1R,11S,12E,17S)-12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carbaldehyde
Molecular FormulaC19H20N2O
Molecular Weight292.4
XLogP2
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count22
Formal Charge0
Complexity592
SMILES
C/C=C\1/CN2CC[C@@]34[C@@H]2C[C@@H]1C(=C3NC5=CC=CC=C45)C=O
InChI
InChI=1S/C19H20N2O/c1-2-12-10-21-8-7-19-15-5-3-4-6-16(15)20-18(19)14(11-22)13(12)9-17(19)21/h2-6,11,13,17,20H,7-10H2,1H3/b12-2-/t13-,17-,19+/m0/s1
InChIKey
VFUITWPFKLGEQA-UQZDHWHBSA-N
Chemical Structure
2D Structure
2D structure of Norfluorocurarine
CAS: 6880-54-2
CID: 5581319
Formula: C19H20N2O
MW: 292.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight292.4
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass292.157563266
Monoisotopic Mass292.157563266
Topological Polar Surface Area32.3 Ų
Heavy Atom Count22
Formal Charge0
Complexity592
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19180928Norfluorocurarine

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