Sinigrin

Modify Date: 2024-01-02 10:50:08

Sinigrin Structure
Sinigrin structure
 Common Name Sinigrin
CAS Number 3952-98-5 Molecular Weight 415.479
Density N/A Boiling Point N/A
Molecular Formula C10H16KNO9S2 Melting Point 128 (dec.)(lit.)ºC
MSDS Chinese USA Flash Point N/A

 Use of Sinigrin


Sinigrin is a major glucosinolate present in plants of the Brassicaceae family, with anti-adipogenic effects[1].

 Names

Name sinigrin
Synonym More Synonyms

 Sinigrin Biological Activity

Description Sinigrin is a major glucosinolate present in plants of the Brassicaceae family, with anti-adipogenic effects[1].
Related Catalog
References

[1]. Lee HW, et al. Inhibitory effect of sinigrin on adipocyte differentiation in 3T3-L1 cells: Involvement of AMPK and MAPK pathways. Biomed Pharmacother. 2018 Jun;102:670-680.

 Chemical & Physical Properties

Melting Point 128 (dec.)(lit.)ºC
Molecular Formula C10H16KNO9S2
Molecular Weight 415.479
Exact Mass 415.000916
PSA 202.62000
Water Solubility almost transparency

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
LZ5778000
CHEMICAL NAME :
Glucopyranose, 1-thio-, 1-(3-butenohydroximate) NO-(hydrogensulfate), monopotassium salt, beta-D-
CAS REGISTRY NUMBER :
3952-98-5
LAST UPDATED :
199712
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C10-H16-N-O9-S2.K
MOLECULAR WEIGHT :
397.49
WISWESSER LINE NOTATION :
T6OTJ BSY2U1&UNOSWO CQ DQ EQ F1Q &-KA-

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
644 mg/kg
SEX/DURATION :
female 8-9 day(s) after conception
TOXIC EFFECTS :
Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
644 mg/kg
SEX/DURATION :
female 8-9 day(s) after conception
TOXIC EFFECTS :
Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)

MUTATION DATA

TYPE OF TEST :
Cytogenetic analysis
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
4600 mg/L
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 348,19,1995

 Safety Information

Personal Protective Equipment Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard Codes Xi
Safety Phrases S24/25
RIDADR NONH for all modes of transport
WGK Germany 3
RTECS LZ5778000
HS Code 29389090

 Articles27

More Articles
Interactive effects of sulfur and nitrogen supply on the concentration of sinigrin and allyl isothiocyanate in Indian mustard (Brassica juncea L.).

J. Agric. Food Chem. 57(9) , 3837-44, (2009)

Food derived from Brassica species is rich in glucosinolates. Hydrolysis of these compounds by myrosinase yields isothiocyanates and other breakdown products, which due to their pungency represent the...

Multidirectional time-dependent effect of sinigrin and allyl isothiocyanate on metabolic parameters in rats.

Plant Foods Hum. Nutr. 65(3) , 217-24, (2010)

Sinigrin (SIN) and allyl isothiocyanate (AITC) are compounds found in high concentrations in Brassica family vegetables, especially in Brussels sprouts. Recently, they have been used as a nutrition su...

Allyl isothiocyanate-rich mustard seed powder inhibits bladder cancer growth and muscle invasion.

Carcinogenesis 31(12) , 2105-10, (2010)

Allyl isothiocyanate (AITC), which occurs in many common cruciferous vegetables, was recently shown to be selectively delivered to bladder cancer tissues through urinary excretion and to inhibit bladd...

 Synonyms

(−)-Sinigrin hydrate
Allyl glucosinolate
Kalium-[({[(1Z)-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]sulfanyl}-3-buten-1-yliden]amino}oxy)sulfonyl]oxidanid
Kalium-1-S-[(1Z)-N-(sulfonatooxy)-3-butenimidoyl]-1-thio-β-D-glucopyranose
Myronate Potassium
1-Thio-b-D-glucopyranose 1-[N-(Sulfooxy)-3-butenimidate] Monopotassium Salt
Potassium Myronate
[({[(1Z)-1-{[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxyméthyl)tétrahydro-2H-pyran-2-yl]sulfanyl}-3-butèn-1-ylidène]amino}oxy)sulfonyl]oxidanide de potassium
Potassium 1-S-[(1Z)-N-(sulfonatooxy)-3-butenimidoyl]-1-thio-β-D-glucopyranose
Potassium [({[(1Z)-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]sulfanyl}-3-buten-1-ylidene]amino}oxy)sulfonyl]oxidanide
MFCD00149447
Sinigroside
EINECS 223-545-8
Potassium 1-S-[(1E)-N-(sulfonatooxy)-3-butenimidoyl]-1-thio-β-D-glucopyranose hydrate (1:1:1)
1-S-[(1Z)-N-(Sulfonatooxy)-3-butènan-1-imidoyl]-1-thio-β-D-glucopyranose de potassium
Sinigrin Hydrate
β-D-Glucopyranose, 1-S-[(1E)-1-[(sulfooxy)imino]-3-buten-1-yl]-1-thio-, potassium salt, hydrate (1:1:1)
Sinigrin
Potassium 1-S-[(1Z)-N-(sulfonatooxy)but-3-enimidoyl]-1-thio-β-D-glucopyranose
β-D-Glucopyranose, 1-S-[(1Z)-1-[(sulfooxy)imino]-3-buten-1-yl]-1-thio-, potassium salt (1:1)
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