Glucosinolates

Description:

Carbohydrate derivatives containing a N-(sulfooxy)ethenimidothioic acid derivative attached to the C1 carbon of glucose moiety.

Ancestors:

Organic compounds ⮕ Organic oxygen compounds ⮕ Organooxygen compounds ⮕ Carbohydrates and carbohydrate conjugates ⮕ Monosaccharides ⮕ Hexoses ⮕ Glucosinolates

Popular Products

sinigrin
Moligand™ ?

Out of Stock Item #: S613588

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Technical Identifiers

IUPAC Name

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-N-sulfooxybut-3-enimidothioate

SMILES

C=CC/C(=N\OS(=O)(=O)O)/S[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O

InChIKey
PHZOWSSBXJXFOR-PTGZALFTSA-N

InChI

1S/C10H17NO9S2/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18)/b11-6+/t5-,7-,8+,9-,10+/m1/s1

Synonyms
Myronic acid | [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-N-sulfooxybut-3-enimidothioate | S...
Sinigrin Hydrate
CAS: 3952-98-5 PubChem CID: 23682211 Formula: C₁₀H₁₆NO₉S₂·K·xH₂O Molecular Weight: 397.46 (anhydrous basis)

10mM in DMSO

Out of Stock Item #: S423819

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Technical Identifiers

IUPAC Name

potassium;[(E)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylbut-3-enylideneamino] sulfate

SMILES

C=CCC(=NOS(=O)(=O)[O-])SC1C(C(C(C(O1)CO)O)O)O.[K+]

InChIKey
QKFAFSGJTMHRRY-OCFLFPRFSA-M

InChI

1S/C10H17NO9S2.K/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10;/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18);/q;+1/p-1/b11-6+;/t5-,7-,8+,9-,10show more

Synonyms
SCHEMBL17239385 | CCG-268622 | Sinigrin potassium salt | FS-7028 | (-)-Sinigrin hydrate | AC-34287 | HY-N0404 | Sinig...
Sinigrin Hydrate
CAS: 3952-98-5 PubChem CID: 23682211 Formula: C₁₀H₁₆NO₉S₂·K·xH₂O Molecular Weight: 397.46 (anhydrous basis)

Moligand™ ? ≥98%

In Stock Item #: S121209

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Pricing & Pack Sizes
Technical Identifiers

IUPAC Name

potassium;[(E)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylbut-3-enylideneamino] sulfate

SMILES

C=CCC(=NOS(=O)(=O)[O-])SC1C(C(C(C(O1)CO)O)O)O.[K+]

InChIKey
QKFAFSGJTMHRRY-OCFLFPRFSA-M

InChI

1S/C10H17NO9S2.K/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10;/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18);/q;+1/p-1/b11-6+;/t5-,7-,8+,9-,10show more

Synonyms
SCHEMBL17239385 | CCG-268622 | Sinigrin potassium salt | FS-7028 | (-)-Sinigrin hydrate | AC-34287 | HY-N0404 | Sinig...
Glucoraphanin potassium salt
CAS: 21414-41-5 PubChem CID: 9548634 Formula: C₁₂H₂₃NO₁₀S₃ Molecular Weight: 437.51

≥98%

Out of Stock Item #: G275165

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Technical Identifiers

IUPAC Name

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-5-methylsulfinyl-N-sulfooxypentanimidothioate

SMILES

CS(=O)CCCCC(=NOS(=O)(=O)O)SC1C(C(C(C(O1)CO)O)O)O

InChIKey
GMMLNKINDDUDCF-RFOBZYEESA-N

InChI

1S/C12H23NO10S3/c1-25(18)5-3-2-4-8(13-23-26(19,20)21)24-12-11(17)10(16)9(15)7(6-14)22-12/h7,9-12,14-17H,2-6H2,1H3,(H,19,20,21)/b13-8+/t7-,9-,10+,11-,1show more

Synonyms
CCRIS 9055 | RAA | 4-methylsulfinylbutyl glucosinolate | MFCD08460269 | SCHEMBL16653150 | DTXSID90894071 | A879116 | ...

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