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3-Demethyl Colchicine-d3

CAT: 1459-CS-T-51842Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-T-51842Size:1 Each
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Description
3-Demethyl Colchicine-d3 is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Colchicine. The product is supplied by Clearsynth under CAT No. CS-T-51842. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
1314417-96-3
Synonyms
3-Demethyl Colchicine-d3
Molecular Formula
C 21 H 20 D 3 NO 6
Molecular Weight
388.4
Additionnal Information
3-Demethyl Colchicine-d3 is supplied with detailed characterization data compliant with regulatory guideline. 3-Demethyl Colchicine-d3 can be used for analytical method development, method validation (AMV), Quality Control (QC) application for Abbreviated New Drug Application (ANDA), or during commercial production of Colchicine.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

3-Demethyl Colchicine-d3
CAS Number1314417-96-3
PubChem CID53312104
IUPAC Name2,2,2-trideuterio-N-[(7S)-3-hydroxy-1,2,10-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
Molecular FormulaC21H23NO6
Molecular Weight388.4
XLogP0.7
Topological Polar Surface Area94.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count28
Formal Charge0
Complexity724
SMILES
[2H]C([2H])([2H])C(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)O
InChI
InChI=1S/C21H23NO6/c1-11(23)22-15-7-5-12-9-17(25)20(27-3)21(28-4)19(12)13-6-8-18(26-2)16(24)10-14(13)15/h6,8-10,15,25H,5,7H2,1-4H3,(H,22,23)/t15-/m0/s1/i1D3
InChIKey
JRRUSQGIRBEMRN-VSLDJYOXSA-N
Chemical Structure
2D Structure
2D structure of 3-Demethyl Colchicine-d3
CAS: 1314417-96-3
CID: 53312104
Formula: C21H23NO6
MW: 388.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight388.4
XLogP30.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass388.17136769
Monoisotopic Mass388.17136769
Topological Polar Surface Area94.1 Ų
Heavy Atom Count28
Formal Charge0
Complexity724
Isotope Atom Count3
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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