SMB01325
阿苯达唑亚砜
≥97% (HPLC)
别名:
[5-（丙烷-1-亚磺酰基）-1H-苯并咪唑-2-基]-氨基甲酸甲酯, 氧阿苯达唑, 阿苯达唑亚砜
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关于此项目
经验公式（希尔记法）:
C12H15N3O3S
化学文摘社编号:
分子量:
281.33
NACRES:
NA.77
UNSPSC Code:
12352119
Beilstein/REAXYS Number:
677664
MDL number:
产品名称
阿苯达唑亚砜, ≥97% (HPLC)
Quality Level
SMILES string
CCCS(=O)c1ccc2[nH]c(NC(=O)OC)nc2c1
InChI
1S/C12H15N3O3S/c1-3-6-19(17)8-4-5-9-10(7-8)14-11(13-9)15-12(16)18-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)
InChI key
VXTGHWHFYNYFFV-UHFFFAOYSA-N
description
Modulation and Signaling
assay
≥97% (HPLC)
form
solid
color
white to beige
suitability
HPTLC
storage temp.
2-8°C
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Biochem/physiol Actions
罗苯达唑是阿苯达唑的关键代谢产物，并作为驱虫药。研究表明，它可能通过使细胞周期停滞在 G2/M 期而诱导人癌细胞 HT-29 凋亡。
Application
Metabolomics research
General description
Albendazole sulfoxide is a blood-brain barrier main metabolite of anti-parasitic agent albendazole that acts as a antihelminthic. It binds to colchicine binding site of β-tubulin and prevents polymerization. Albendazole sulfoxide exhibits greater affinity to parasitic β-tubulin than to mammalian.
Other Notes
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signalword
Warning
hcodes
Hazard Classifications
Aquatic Acute 1 - Aquatic Chronic 1 - Repr. 2 - Skin Sens. 1 - STOT RE 2 Oral
target_organs
Adrenal gland,spleen,male reproductive organs,Blood
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
Lidia Radko et al.
Journal of veterinary research, 61(3), 313-319 (2018-07-07)
Albendazole is used to treat endoparasitic diseases in animals and humans. After oral administration, it is quickly oxidised into its pharmacologically active metabolite albendazole sulfoxide and then to sulfone. However, it is not clear which compound is responsible for toxic
Maximo Pettarin et al.
European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences, 155, 105552-105552 (2020-09-17)
The aim of this study was to use a combined in vitro-in silico approach to develop a physiologically based pharmacokinetic model (PBPK) that predicts the bioavailability of albendazole (ABZ), a BCS class II/IV lipophilic weak base, and simulates its main
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