CC(C)SC1C(C(C(C(O1)CO)O)O)O
CAS: 367-93-1
名称: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-propan-2-ylsulfanyloxane-3,4,5-triol
SMILES: CC(C)SC1C(C(C(C(O1)CO)O)O)O

分子加工

分子式
C9H18O5S
分子量
238.3
精确质量
238.0875
XLogP
-1.07
TPSA
90.15
氢键给体数
4
氢键受体数
6
可旋转键
3
重原子数
15
环数
1
芳香环
0
饱和环
1
脂环
1
立体中心
5
未定义立体
5
形式电荷
0
杂原子数
6
共价单元
1
sp3占比
1
摩尔折射率
56.49

补充信息

InChIKey: BPHPUYQFMNQIOC-NXRLNHOXSA-N
同义词
IPTG367-93-1Isopropyl-beta-D-thiogalactopyranosideIsopropyl beta-D-thiogalactopyranosideISOPROPYL THIOGALACTOSIDEIsopropyl-beta-D-thiogalactosideIsopropyl beta-D-1-thiogalactopyranosideIsopropyl 1-Thio-beta-D-galactopyranosideIsopropyl beta-D-thiogalactosideDTXSID6041052X73VV2246B(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-propan-2-ylsulfanyloxane-3,4,5-triolCHEBI:61448beta-D-Galactopyranoside, 1-methylethyl 1-thio-(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-propan-2-ylsulfanyl-oxane-3,4,5-triolThiogalactoside, Isopropylisopropyl beta-thiogalactosideIsopropyl 1 Thio beta D galactopyranoside1-Thio-beta-D-galactopyranoside, IsopropylRefChem:389084DTXCID4021052(3R,4R,6S)-2-(hydroxymethyl)-6-isopropylsulfanyl-tetrahydropyran-3,4,5-triol206-703-0(2R,3R,4S,5R,6S)-2-(Hydroxymethyl)-6-(isopropylthio)tetrahydro-2H-pyran-3,4,5-triolb-D-Galactopyranoside, 1-methylethyl 1-thio-Isopropy-beta-D-thiogalactopyranosideMFCD00063273Isopropyl |A-D-thiogalactoside1-Methylethyl 1-thio-beta-D-galactopyranoside.beta.-D-Galactopyranoside, 1-methylethyl 1-thio-
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