NSC-226572
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MedKoo CAT#: 540293

CAS#: 6853-87-8

Description: NSC-226572, also known as Alanine, 3-(methylsulfinyl)-, L-, pyrolyzate, S-methyl-L-cysteine-S-oxide; S-Methylcysteine sulfoxide, is a synthetic analog of alliin found in cruciferous vegetables including cabbage, turnip, cauliflower, and kale. NSC-226572 is converted through alliinase activity into a volatile thiosulfinate.


Chemical Structure

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NSC-226572
CAS# 6853-87-8

Theoretical Analysis

MedKoo Cat#: 540293
Name: NSC-226572
CAS#: 6853-87-8
Chemical Formula: C4H9NO3S
Exact Mass: 151.03
Molecular Weight: 151.180
Elemental Analysis: C, 31.78; H, 6.00; N, 9.27; O, 31.75; S, 21.21

Price and Availability

Size Price Availability Quantity
100mg USD 230
250mg USD 430
1g USD 785
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Synonym: Methyiin, pyrolyzate; NSC 226572; NSC-226572; NSC226572; S-methyl-L-cysteine-S-oxide; S-Methylcysteine sulfoxide;

IUPAC/Chemical Name: ((S)-methylsulfinyl)-L-alanine

InChi Key: ZZLHPCSGGOGHFW-OLLQQOEVSA-N

InChi Code: InChI=1S/C4H9NO3S/c1-9(8)2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-,9+/m1/s1

SMILES Code: O=[S@@](C)C[C@@H](N)C(O)=O

Appearance: Solid powder

Purity: >98% (or refer to the Certificate of Analysis)

Shipping Condition: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.

Storage Condition: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

Solubility: Soluble in DMSO

Shelf Life: >2 years if stored properly

Drug Formulation: This drug may be formulated in DMSO

Stock Solution Storage: 0 - 4 C for short term (days to weeks), or -20 C for long term (months).

HS Tariff Code: 2934.99.9001

More Info:

Product Data:
Biological target: (2R)-2-Amino-3-(methylsulfinyl)propanoic acid is a cysteine derivative.
In vitro activity: TBD
In vivo activity: TBD

Solubility Data

Solvent Max Conc. mg/mL Max Conc. mM
Solubility
PBS (pH 7.2) 10.0 66.15

Preparing Stock Solutions

The following data is based on the product molecular weight 151.18 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
Formulation protocol: TBD
In vitro protocol: TBD
In vivo protocol: TBD

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