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Substance Name: Indole-5,7-diol, 3-(2-aminoethyl)-, compd. with 2-amino-1,5-dihydro-1-methyl-4H-imidazol-4-one, sulfate, hydrate (1:1:1:2)
RN: 39929-27-6
InChIKey: BXYXUOWJXUUTQZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H12-N2-O2.C4-H7-N3-O.H2-O4-S.2H2-O

Molecular Weight

  • 403.414
 
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Names and Synonyms

Synonym

  • 5,7-Dht creatinine sulfate dihydrate

Systematic Name

  • Indole-5,7-diol, 3-(2-aminoethyl)-, compd. with 2-amino-1,5-dihydro-1-methyl-4H-imidazol-4-one, sulfate, hydrate (1:1:1:2)

Registry Numbers

CAS Registry Number

  • 39929-27-6

Other Registry Numbers

  • 51166-58-6
  • 52147-22-5
  • 67640-13-5

System Generated Number

  • 0039929276

Molecular Formulas

Molecular Formula

  • C10-H12-N2-O2.C4-H7-N3-O.H2-O4-S.2H2-O

Molecular Formula Fragments

  • C10-H12-N2-O2
  • C4-H7-N3-O
  • COMPONENT
  • H2-O
  • H2-O4-S

Structure Descriptors

InChI

1S/C10H12N2O2.C4H7N3O.H2O4S/c11-2-1-6-5-12-10-8(6)3-7(13)4-9(10)14;1-7-2-3(8)6-4(7)5;1-5(2,3)4/h3-5,12-14H,1-2,11H2;2H2,1H3,(H2,5,6,8);(H2,1,2,3,4)

InChIKey

BXYXUOWJXUUTQZ-UHFFFAOYSA-N

Smiles

c12c([nH]cc1CCN)c(cc(c2)O)O.C1(CN(C)C(=N1)[NH2+])=O.S(O)(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intracrebral 3932ug/kg (3.932mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Pharmacology, Biochemistry and Behavior. Vol. 2, Pg. 769, 1974.