Cas no 37209-31-7 (Detralfate (9CI))
Detralfate (9CI) structure
Product Name:Detralfate (9CI)
CAS No:37209-31-7
MF:C12H22O25S5
MW:726.613080501556
CID:305975
PubChem ID:3084656
Update Time:2025-04-19
Detralfate (9CI) Chemical and Physical Properties
Names and Identifiers
-
- [(2S,3R,4S,5R,6R)-2-hydroxy-6-[[(2S,3R,4S,5R,6R)-5-hydroxy-6-methyl-3,4-disulfooxyoxan-2-yl]oxymethyl]-3,5-disulfooxyoxan-4-yl] hydrogen sulfate
- 6-O-(6-deoxy-2,3-di-O-sulfo-alpha-D-glucopyranosyl)-2,3,4-tri-O-sulfo-alpha-D-glucopyranose
- APD
- Dextran sulfate sodium aluminium
- Dextran sulfate, sodium salt, aluminum complex
- Detralfate [INN]
- UNII-YD5EC2W2Z5
- Detralfate
- Detralfato [INN-Spanish]
- 37209-31-7
- Detralfatum
- AKOS040751534
- Detralfato
- (2S,3R,4S,5R,6R)-2-hydroxy-6-((((2S,3R,4S,5R,6R)-5-hydroxy-6-methyl-3,4-bis(sulfooxy)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-3,4,5-triyl tris(hydrogen sulfate)
- Detralfatum [INN-Latin]
- YD5EC2W2Z5
- NS00123461
- Detralfate (9CI)
-
- Inchi： 1S/C12H22O25S5/c1-3-5(13)7(34-39(18,19)20)10(37-42(27,28)29)12(31-3)30-2-4-6(33-38(15,16)17)8(35-40(21,22)23)9(11(14)32-4)36-41(24,25)26/h3-14H,2H2,1H3,(H,15,16,17)(H,18,19,20)(H,21,22,23)(H,24,25,26)(H,27,28,29)/t3-,4-,5-,6-,7+,8+,9-,10-,11+,12+/m1/s1
- InChI Key： MJBAKMXCLOFQBX-NCFXGAEVSA-N
- SMILES： S(=O)(=O)(O)O[C@H]1[C@@H]([C@H]([C@@H](O)O[C@@H]1CO[C@@H]1[C@@H]([C@H]([C@@H]([C@@H](C)O1)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O
Computed Properties
- Exact Mass: 725.905
- Monoisotopic Mass: 725.905
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 7
- Hydrogen Bond Acceptor Count: 25
- Heavy Atom Count: 42
- Rotatable Bond Count: 13
- Complexity: 1460
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 10
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -6.2
- Topological Polar Surface Area: 428?2
Experimental Properties
- Color/Form: Solid powder
- Density: 2.26
- Refractive Index: 1.685
Detralfate (9CI) Security Information
- Signal Word：Warning
- Storage Condition：Dry, dark and store at 0-4℃ for short term (days to weeks) or -20℃ for long term (Store correctly 2-3years).
Detralfate (9CI) Related Literature
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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