646-23-1,MFCD00214145
Catalog No.:AA00EB7O

646-23-1 | ALYSSIN

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥95%
in stock  
$46.00   $32.00
- +
5mg
≥95%
in stock  
$138.00   $96.00
- +
10mg
≥95%
in stock  
$229.00   $160.00
- +
25mg
≥95%
in stock  
$343.00   $240.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00EB7O
Chemical Name:
ALYSSIN
CAS Number:
646-23-1
Molecular Formula:
C7H13NOS2
Molecular Weight:
191.3142
MDL Number:
MFCD00214145
SMILES:
S=C=NCCCCCS(=O)C
Properties
Computed Properties
 
Complexity:
164  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.8  

Literature

Title: Isothiocyanate-drug interactions in the human adenocarcinoma cell line Caco-2.

Journal: Molecular and cellular biochemistry 20120801

Title: Comparison of the apoptosis-inducing capability of sulforaphane analogues in human colon cancer cells.

Journal: Anticancer research 20100901

Title: The effect of isothiocyanates on CYP1A1 and CYP1A2 activities induced by polycyclic aromatic hydrocarbons in Mcf7 cells.

Journal: Toxicology in vitro : an international journal published in association with BIBRA 20090801

Title: Sulforaphane and its analogues inhibit CYP1A1 and CYP1A2 activity induced by benzo[a]pyrene.

Journal: Journal of biochemical and molecular toxicology 20090101

Title: Differential response of human healthy lymphoblastoid and CCRF-SB leukemia cells to sulforaphane and its two analogues: 2-oxohexyl isothiocyanate and alyssin.

Journal: Pharmacological reports : PR 20070101

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SDS
Historical Records
Tags:646-23-1 Molecular Formula|646-23-1 MDL|646-23-1 SMILES|646-23-1 ALYSSIN
Catalog No.: AA00EB7O
646-23-1,MFCD00214145
646-23-1 | ALYSSIN
Pack Size: 1mg
Purity: ≥95%
in stock
$46.00 $32.00
Pack Size: 5mg
Purity: ≥95%
in stock
$138.00 $96.00
Pack Size: 10mg
Purity: ≥95%
in stock
$229.00 $160.00
Pack Size: 25mg
Purity: ≥95%
in stock
$343.00 $240.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00EB7O
Chemical Name: ALYSSIN
CAS Number: 646-23-1
Molecular Formula: C7H13NOS2
Molecular Weight: 191.3142
MDL Number: MFCD00214145
SMILES: S=C=NCCCCCS(=O)C
Properties
Complexity: 164  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.8  
Literature fold

Title: Isothiocyanate-drug interactions in the human adenocarcinoma cell line Caco-2.

Journal: Molecular and cellular biochemistry20120801

Title: Comparison of the apoptosis-inducing capability of sulforaphane analogues in human colon cancer cells.

Journal: Anticancer research20100901

Title: The effect of isothiocyanates on CYP1A1 and CYP1A2 activities induced by polycyclic aromatic hydrocarbons in Mcf7 cells.

Journal: Toxicology in vitro : an international journal published in association with BIBRA20090801

Title: Sulforaphane and its analogues inhibit CYP1A1 and CYP1A2 activity induced by benzo[a]pyrene.

Journal: Journal of biochemical and molecular toxicology20090101

Title: Differential response of human healthy lymphoblastoid and CCRF-SB leukemia cells to sulforaphane and its two analogues: 2-oxohexyl isothiocyanate and alyssin.

Journal: Pharmacological reports : PR20070101

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