Desulfo-glucoraphanin , CAS No.287966-62-5

CAS: 287966-62-5 Cat. No.: D340662 Formula: C₁₂H₂₃NO₇S Molecular Weight: 357.44 PubChem CID: 71315835

Synonyms

4-Methylsulfinylbutyldesulfoglucosinolate | DTXSID50747579 | Desulfo-glucoraphanin | Desulfo Glucoraphanin | [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z)-N-hydroxy-5-methylsulfinylpentanimidothioate | 1-Thio-1-[N-hydroxy-5-(methylsulfinyl

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Desulfo-glucoraphanin is a glucoraphanin analogue found in cruciferous vegetables.

Specifications

Synonyms

4-Methylsulfinylbutyldesulfoglucosinolate | DTXSID50747579 | Desulfo-glucoraphanin | Desulfo Glucoraphanin | [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z)-N-hydroxy-5-methylsulfinylpentanimidothioate | 1-Thio-1-[N-hydroxy-5-(methylsulfinyl

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Names and Identifiers

• Canonical Smiles: CS(=O)CCCCC(=NO)SC1C(C(C(C(O1)CO)O)O)O
• IUPAC Name: [(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z)-N-hydroxy-5-methylsulfinylpentanimidothioate
• InChIKey: UYHMVWFYYZIVOP-RUAQSNJLSA-N
• INCHI: 1S/C12H23NO7S2/c1-22(19)5-3-2-4-8(13-18)21-12-11(17)10(16)9(15)7(6-14)20-12/h7,9-12,14-18H,2-6H2,1H3/b13-8-/t7?,9-,10+,11?,12+,22?/m1/s1
• Isomeric SMILES: CS(=O)CCCC/C(=N/O)/S[C@H]1C([C@H]([C@@H](C(O1)CO)O)O)O
• PubChem CID: 71315835
• Molecular Weight: 357.44

Chemical and Physical Properties

• Solubility: Soluble in ethanol, and water.
• x_refractive_index: n20D~1.66 (Predicted)
• x_melt_point_char: 140-143° C

Frequently Asked Questions

How should this product be stored?

Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 287966-62-5, the molecular formula is C12H23NO7S, and the molecular weight is 357.44 g/mol. InChIKey UYHMVWFYYZIVOP-RUAQSNJLSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.