Basic information
- CAS
66347-27-1- Standard SMILES
C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3ccc([N+](=O)[O-])cc3)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O- InChIKey
FMNXEBSKDAQHBI-YUXDDOTLSA-N- Molecular formula
- C18H25NO12
- Average molar mass
- 447.4 g/mol
- Monoisotopic mass
- 447.13767523
Overview
chromogenic substrate for substrate-specific alpha-L-fucosidase; RN & N1 from CA Vol 91 Form Index
Names & identifiers
- Preferred name
- 4-nitrophenyl-2-O-(alpha-L-fucopyranosyl)-beta-D-galactopyranoside
- IUPAC
- (2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol
- English name
- p-Nitrophenyl 2-O-(a-L-fucopyranosyl)-D-galactopyranoside
- Molecular formula
- C18H25NO12
- Molecular weight
- 447.39
Names & synonyms
66347-27-1Npafpbg4-Nitrophenyl-2-O-(alpha-L-fucopyranosyl)-beta-D-galactopyranosideDTXSID90216557Para-nitrophenyl-2-O-(alpha-L-fucopyranosyl)-beta-D-galactopyranosidebeta-D-Galactopyranoside, 4-nitrophenyl 2-O-(6-deoxy-alpha-L-galactopyranosyl)-RefChem:100126DTXCID20139048p-Nitrophenyl 2-O-(alpha-L-fucopyranosyl)-beta-D-galactopyranoside(2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]oxy-6-methyloxane-3,4,5-triolp-Nitrophenyl 2-O-(a-L-fucopyranosyl)-b-D-galactopyranoside(2S,3S,4R,5S,6S)-2-(((2S,3R,4S,5R,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)tetrahydro-2H-pyran-3-yl)oxy)-6-methyltetrahydro-2H-pyran-3,4,5-triol
Show more names
Fuc1-a-2Gal-PNPp-nitrophenyl 2-O-α-L-furanosyl-β-D-galactopyranoside4-Nitrophenyl2-O-(a-L-fucopyranosyl)-b-D-galactopyranosidep-Nitrophenyl 2-O-(α-L-fucopyranosyl)-β-D-galactopyranosideβ-D-Galactopyranoside, 4-nitrophenyl 2-O-(6-deoxy-α-L-galactopyranosyl)-
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 204 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 597
Physicochemical properties
- Melting point
- 253 · 253-254°C dec.
- Boiling point
- 740.5 · 740.5±60.0 °C(Predicted)
- Density
- 1.62 · 1.62±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Methanol (Slightly, Heated, Sonicated)
- form
- Solid
- pka
- 12 · 12+-.0.70(Predicted)
- color
- White to Off-White
Chemistry & industry
Applications
UsesA synthetic chromogenic substrate for the assay of a-fucosidases.
Suppliers10 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
武汉开诺医药科技有限公司18040571231/1402788087
凯试（上海）科技有限公司021-50135380 · [email protected]
北京秦岭医药科技有限公司010-61241352 18901327973 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
上海依赫生物科技有限公司021-68882955 17721395025 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
南京世洲生物科技有限公司13675144456 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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