1-脱氧岩藻野九霉素盐酸盐

Deoxyfuconojirimycin

HCID 122618CAS 99212-30-3

基本信息

标准SMILES: C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
InChIKey: VYOCYWDJTQRZLC-KCDKBNATSA-N
分子式: C6H13NO3
平均分子量: 147.17 g/mol
单同位素质量: 147.08954328

概述

Deoxyfuconojirimycin is a hydroxypiperidine in which the three hydroxy substituents are located at positions 3, 4 and 5 together with an additional methyl substituent at position 2. It has a role as a fungal metabolite. It is a triol and a hydroxypiperidine.

名称与标识

首选名称: Deoxyfuconojirimycin
IUPAC: (2S,3R,4S,5R)-2-methylpiperidine-3,4,5-triol
中文名: 1-脱氧岩藻野九霉素盐酸盐
英文名: Deoxyfuconojirimycin, hydrochloride
分子式: C6H13NO3
分子量: 147.17

名称与别名

Deoxyfuconojirimycin99212-30-3(2S,3R,4S,5R)-2-methylpiperidine-3,4,5-triol1,2,6-Trideoxy-2,6-imino-D-galactitol1,5-Dideoxy-1,5-iminofucitolDeoxyfuco-nojirimycinCHEBI:132866RefChem:485684Deoxyfuconojirimycin,hydrochlorideCHEMBL3147723,4,5-Piperidinetriol, 2-methyl-, (2S,3R,4S,5R)-2-methylpiperidine-3,4,5-triol

展开更多名称

1-脱氧岩藻野九霉素盐酸盐1-脱氧岩澡塘糖野尻霉素盐酸盐1-脱氧岩藻野尻霉素盐酸盐(DFJ)(2S,3R,4S,5R)-2-甲基哌啶-3,4,5-三醇(2S,3R,4S,5R)-2-甲基-3,4,5-哌啶三醇DFJDFJ, HYDROCHLORIDE1-DeoxyfuconojirimycinDEOXYFUCONOJIRIMYCIN HCL1-DeoxyfuconojiriMycin HCl (DFJ)Deoxyfuconojirimycin, hydrochloride1-Deoxyfuconojirimycin hydrochloride1,5-DIDEOXY-1,5-IMINO-L-FUCITOL, HCL1-Deoxyfuconojirimycin hydrochloride ,98%

L-fuco-DeoxynojirimycinFucosidase Inhibitor, 31-Deoxyfuconojirimycin HClSCHEMBL4378188DTXSID60912837VYOCYWDJTQRZLC-KCDKBNATSA-N1,5-Dideoxy-1,5-imino-L-fucitolBDBM50065258

数据库标识

CAS: 99212-30-3
PubChem CID: 122618
DTXSID: DTXSID60912837
ChEMBL: CHEMBL314772
ChEBI: CHEBI:132866
Nikkaji: J653.804E

性质

结构计算性质

XLogP: -1.9
极性表面积: 72.7 Å²
氢键供体: 4
氢键受体: 4
可旋转键: 0
重原子: 10
形式电荷: 0
复杂度: 120

物理化学性质

熔点: 155 · 155-157
储存条件: Refrigerator, Under Inert Atmosphere
溶解度: Methanol (Slightly, Sonicated), Water (Slightly)
形态: Solid
颜色: Pale Beige to Beige

安全与法规

危害信息

Regulatory Information3,4,5-Piperidinetriol, 2-methyl-, (2S,3R,4S,5R)-: Does not have an individual approval but may be used under an appropriate group standard

安全数据

海关编码: 29329990

化学与工业

供应商16 家

上海优宁维生物科技股份有限公司15921930842 15921930842 · [email protected]

上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]

武汉易泰科技有限公司上海分公司18930552037 · [email protected]

上海维亦特生物科技有限公司15317051735 · [email protected]

杭州璟皓生物科技有限公司（原河南辛迪加生物）17513242016 · [email protected]

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