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Substance Name: Hydroxydione sodium succinate [INN:BAN]
RN: 53-10-1
UNII: 53J8I8O5EW
InChIKey: BFQDICGJHAONBN-OOFWROCWSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H36-O6.Na

Molecular Weight

  • 454.5355
 
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Names and Synonyms

Name of Substance

  • Hydroxydione sodium succinate [INN:BAN]

Synonyms

  • 21-(3-Carboxy-1-oxopropoxy)-5-beta-pregnane-3,20-dione sodium salt
  • 21-Hydroxy-5-beta-pregnane-3,20-dione, sodium salt, hemisuccinate
  • 21-Hydroxy-5beta-pregnane-3,20-dione 21-(sodium succinate)
  • 21-Hydroxypregnane-3,20-dione sodium hemisuccinate
  • Hidroxidiona succinato sodico
  • Hidroxidiona succinato sodico [INN-Spanish]
  • Hydroxidioni natrii succinas
  • Hydroxydione
  • Hydroxydione sodium succinate
  • Hydroxydione succinate
  • Hydroxydione succinate de sodium
  • Hydroxydione succinate de sodium [INN-French]
  • Hydroxydioni natrii succinas
  • Hydroxydioni natrii succinas [INN-Latin]
  • Idrossidione sodio succinato
  • Idrossidione sodio succinato [DCIT]
  • Natrium-(3,20-dioxo-5beta-pregnan-21-yl)-hydrogensuccinat
  • P 55
  • Presuren
  • Succinate sodique de 21-hydroxypregnandione
  • Succinate sodique de 21-hydroxypregnandione [French]
  • UNII-53J8I8O5EW
  • Viadril

Systematic Names

  • 21-Hydroxy-5beta-pregnane-3,20-dione 21-(sodium succinate)
  • 5-beta-Pregnane-3,20-dione, 21-hydroxy-, sodium hemisuccinate

Registry Numbers

CAS Registry Number

  • 53-10-1

FDA UNII

  • 53J8I8O5EW

System Generated Number

  • 0000053101

Molecular Formulas

Molecular Formula

  • C25-H36-O6.Na

Molecular Formula Fragments

  • C25-H36-O6
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C25H36O6.Na/c1-24-11-9-16(26)13-15(24)3-4-17-18-5-6-20(25(18,2)12-10-19(17)24)21(27)14-31-23(30)8-7-22(28)29;/h15,17-20H,3-14H2,1-2H3,(H,28,29);/q;+1/p-1/t15-,17+,18+,19+,20-,24+,25+;/m1./s1

InChIKey

BFQDICGJHAONBN-OOFWROCWSA-M

Smiles

[C@H]12[C@H]3[C@@H]([C@@]4([C@H](CC3)CC(=O)CC4)C)CC[C@@]1([C@H](CC2)C(=O)COC(=O)CCC(=O)[O-])C.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 250mg/kg (250mg/kg) BEHAVIORAL: GENERAL ANESTHETIC Journal of Pharmacology and Experimental Therapeutics. Vol. 115, Pg. 432, 1955.
mouse LD50 oral 1200mg/kg (1200mg/kg) BEHAVIORAL: GENERAL ANESTHETIC Journal of Pharmacology and Experimental Therapeutics. Vol. 115, Pg. 432, 1955.
mouse LD50 subcutaneous 310mg/kg (310mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 107, Pg. 159, 1956.
mouse LDLo intraperitoneal 640mg/kg (640mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 117, 1968.
rabbit LD50 intravenous 95mg/kg (95mg/kg) BEHAVIORAL: GENERAL ANESTHETIC Journal of Pharmacology and Experimental Therapeutics. Vol. 115, Pg. 432, 1955.
rat LD50 intraperitoneal 190mg/kg (190mg/kg)   Therapie. Vol. 32, Pg. 375, 1977.
rat LD50 intravenous 190mg/kg (190mg/kg) BEHAVIORAL: GENERAL ANESTHETIC Journal of Pharmacology and Experimental Therapeutics. Vol. 115, Pg. 432, 1955.
rat LD50 oral 700mg/kg (700mg/kg) BEHAVIORAL: GENERAL ANESTHETIC Journal of Pharmacology and Experimental Therapeutics. Vol. 115, Pg. 432, 1955.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 201 dec deg C   EXP
log P (octanol-water) -0.560 (none)   EST
Atmospheric OH Rate Constant 4.02E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.