Products for Research Use Only

Aflatoxin G1-13C17

CAT: 1459-CS-O-45498Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-45498Size:1 Each
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Description
Aflatoxin G1-13C17 is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Aflatoxin. The product is supplied by Clearsynth under CAT No. CS-O-45498. 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
1217444-07-9
Synonyms
Aflatoxin G1-13C17
Molecular Formula
13 C 17 H 12 O 7
Molecular Weight
345.15
Additionnal Information
Aflatoxin G1-13C17 is supplied with detailed characterization data compliant with regulatory guideline. Aflatoxin G1-13C17 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 Aflatoxin.
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

(3S,7R)-11-(113C)methoxy-6,8,16,20-tetraoxapentacyclo(10.8.0.02,9.03,7.013,18)icosa-1,4,9,11,13(18)-pentaene-17,19-dione
CAS Number1217444-07-9
PubChem CID71312517
IUPAC Name(3S,7R)-11-(113C)methoxy-6,8,16,20-tetraoxapentacyclo[10.8.0.02,9.03,7.013,18]icosa-1,4,9,11,13(18)-pentaene-17,19-dione
Molecular FormulaC17H12O7
Molecular Weight345.15
XLogP1.8
Topological Polar Surface Area80.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count1
Heavy Atom Count24
Formal Charge0
Complexity666
SMILES
[13CH3]O[13C]1=[13C]2[13C]3=[13C]([13C](=O)O[13CH2][13CH2]3)[13C](=O)O[13C]2=[13C]4[13C@@H]5[13CH]=[13CH]O[13C@@H]5O[13C]4=[13CH]1
InChI
InChI=1S/C17H12O7/c1-20-9-6-10-12(8-3-5-22-17(8)23-10)14-11(9)7-2-4-21-15(18)13(7)16(19)24-14/h3,5-6,8,17H,2,4H2,1H3/t8-,17+/m0/s1/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1,13+1,14+1,15+1,16+1,17+1
InChIKey
XWIYFDMXXLINPU-DENWKYDXSA-N
Chemical Structure
2D Structure
2D structure of (3S,7R)-11-(113C)methoxy-6,8,16,20-tetraoxapentacyclo(10.8.0.02,9.03,7.013,18)icosa-1,4,9,11,13(18)-pentaene-17,19-dione
CAS: 1217444-07-9
CID: 71312517
Formula: C17H12O7
MW: 345.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight345.15
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count1
Exact Mass345.11533492
Monoisotopic Mass345.11533492
Topological Polar Surface Area80.3 Ų
Heavy Atom Count24
Formal Charge0
Complexity666
Isotope Atom Count17
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes