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37209-31-7

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Basic Information
CAS No.: 37209-31-7
Name: Detralfate
Molecular Structure:
Molecular Structure of 37209-31-7 (Detralfate)
Formula: C12H22O25S5
Molecular Weight: 726.61308
Synonyms: Detralfate
Density: 2.26g/cm3
Safety: Poison by intraperitoneal route. Moderately toxic by subcutaneous route. Used as an antipeptic ulcer agent. When heated to decomposition it emits toxic fumes of SOx and Na2O. See also DEXTRAN SULFATE SODIUM.
PSA: 428.05000
LogP: 0.16990
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Chemistry

IUPAC Name: [(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
Synonyms of Detralfate (CAS NO.37209-31-7) : Detralfato ; Detralfatum ; Dextran sulfate sodium aluminium ; Dextran sulfate, sodium salt, aluminum complex
InChI:InChI=1/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
CAS NO:37209-31-7
Molecular Formula:C12H22O25S5
Molecular Weight :726.6131
Molecular Structure :
Index of Refraction: 1.685
Surface Tension: 143.8 dyne/cm
Density: 2.26 g/cm3
Enthalpy of Vaporization: kJ/mol
Vapour Pressure: mmHg at 25°C

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 257mg/kg (257mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 3, Pg. 24, 1972.
mouse LD50 oral > 4gm/kg (4000mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 3, Pg. 24, 1972.
mouse LD50 subcutaneous 2200mg/kg (2200mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 3, Pg. 24, 1972.
rat LD50 intraperitoneal 200mg/kg (200mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 3, Pg. 24, 1972.
rat LD50 oral > 6400mg/kg (6400mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 3, Pg. 24, 1972.
rat LD50 subcutaneous 1600mg/kg (1600mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 3, Pg. 24, 1972.

Safety Profile

Poison by intraperitoneal route. Moderately toxic by subcutaneous route. Used as an antipeptic ulcer agent. When Detralfate (CAS NO.37209-31-7) is heated to decomposition ,it emits toxic fumes of SOx and Na2O. See also DEXTRAN SULFATE SODIUM.