Account Sodium (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-((4-oxo-3-(4-(sulfonatooxy)phenyl)-4H-chromen-7-yl)oxy)tetrahydro-2H-pyran-2-carboxylate
- Catalog No. :
- ACVZDT970
- CAS No. :
- 1041134-19-3
- Molecular Formula :
- C21H16Na2O13S
- Molecular Weight :
- 554.39
IUPAC Name:sodium (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-((4-oxo-3-(4-(sulfonatooxy)phenyl)-4H-chromen-7-yl)oxy)tetrahydro-2H-pyran-2-carboxylate
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Product Information
| Product Name | Sodium (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-((4-oxo-3-(4-(sulfonatooxy)phenyl)-4H-chromen-7-yl)oxy)tetrahydro-2H-pyran-2-carboxylate |
|---|---|
| IUPAC Name | sodium (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-((4-oxo-3-(4-(sulfonatooxy)phenyl)-4H-chromen-7-yl)oxy)tetrahydro-2H-pyran-2-carboxylate |
| Molecular Formula | C21H16Na2O13S |
| Molecular Weight | 554.39 |
| SMILES | O=C1C(C2=CC=C(OS(=O)([O-])=O)C=C2)=COC3=C1C=CC(O[C@H]4[C@@H]([C@H]([C@@H]([C@@H](C([O-])=O)O4)O)O)O)=C3.[Na+].[Na+] |
| InChI Key | VHQPHYREJFCKGH-DSGPYVBMSA-L |
| Synonym | Daidzein 7-β-D-Glucuronide 4’-Sulfate Disodium Salt;4-Oxo-3-[4-(sulfooxy)phenyl]-4H-1-benzopyran-7-yl β-D-Glucopyranosiduronic Acid SodiuM Salt;4-Oxo-3-[4-(sulfooxy)phenyl]-4H-1-benzopyran-7-yl beta-D-glucopyranosiduronic acid sodium salt (1:2);Daidzein 7-b-D-glucuronide 4-sulfate disodium salt;Daidzein-β-D-Glucuronide 4-Sulfate Disodium Salt;Daidzein 7-β-D-Glucuronide 4''-Sulfate Disodium Salt;β-D-Glucopyranosiduronic acid, 4-oxo-3-[4-(sulfooxy)phenyl]-4H-1-benzopyran-7-yl, sodium salt (1:2);Daidzein 7-Beta-D-Glucuronide 4’-Sulfate Disodium Salt |
| CAS No. | 1041134-19-3 |
Synthetic Route by SureRoute
2. ACVZDT970 Molecular Building Block Synthetic Route
(2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-((5-hydroxy-4-oxo-3-(4-(sulfooxy)phenyl)-4H-chromen-7-yl)oxy)tetrahydro-2H-pyran-2-carboxylic acid
(2S,3S,4S,5R,6S)-2-(Methoxycarbonyl)-6-((4-oxo-3-(4-(sulfooxy)phenyl)-4H-chromen-7-yl)oxy)tetrahydro-2H-pyran-3,4,5-triyl triacetate
(2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-((3-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl)oxy)tetrahydro-2H-pyran-2-carboxylic acid