1,1'-(Sulfonylbis((4,1-phenylene)azanediyl))bis(2,3,4,5,6-pentahydroxyhexane-1-sulfonic acid)
Basic information
- CAS
554-18-7- Standard SMILES
O=S(=O)(c1ccc(NC(C(O)C(O)C(O)C(O)CO)S(=O)(=O)O)cc1)c1ccc(NC(C(O)C(O)C(O)C(O)CO)S(=O)(=O)O)cc1- InChIKey
SQQCWHCJRWYRLB-UHFFFAOYSA-N- Molecular formula
- C24H36N2O18S3
- Average molar mass
- 736.7 g/mol
- Monoisotopic mass
- 736.11252582
Names & identifiers
- Preferred name
- 1,1'-(Sulfonylbis((4,1-phenylene)azanediyl))bis(2,3,4,5,6-pentahydroxyhexane-1-sulfonic acid)
- IUPAC
- 2,3,4,5,6-pentahydroxy-1-[4-[4-[(2,3,4,5,6-pentahydroxy-1-sulfohexyl)amino]phenyl]sulfonylanilino]hexane-1-sulfonic acid
Names & synonyms
RefChem:1051583DTXCID40810988DTXSID208621871,1'-(Sulfonylbis((4,1-phenylene)azanediyl))bis(2,3,4,5,6-pentahydroxyhexane-1-sulfonic acid)Sodium glucosulfone, injectionDisodium p,N'-diglucose sulfonatep,N'-di(dextrose sodium sulfonate)p,N'-di-D-glucose sodium bisulfitep,N'-diglucoside disodium disulfonateSolfoneAngeli sulfoneAngeli's sulfone
Show more names
p, N,N'-diglucoside disodium disulfonate501 Siegfried1,1-phenyleneimino)]bis[1-deoxy-1-sulfo-D-glucitol] disodium saltNSC512486D-Glucitol,1'-[sulfonylbis(4,1-phenyleneimino)]bis[1-deoxy-1-sulfo-, disodium saltGlucitol,1'-[sulfonylbis(4,1-phenyleneimino)]bis[1-deoxy-1-sulfo-, disodium salt, D-2,3,4,5,6-pentahydroxy-1-[4-[4-[(2,3,4,5,6-pentahydroxy-1-sulfohexyl)amino]phenyl]sulfonylanilino]hexane-1-sulfonic acidNSC36701
Database identifiers
- CAS
554-18-7- PubChem CID
- 3481
Properties
Computed structural properties
- XLogP
- -4.4
- Topological polar surface area
- 394 Ų
- Hydrogen bond donors
- 14
- Hydrogen bond acceptors
- 20
- Rotatable bonds
- 18
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 1,180
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