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Substance Name: Propanamide, 3-amino-N-(2-(5-hydroxy-1H-indol-3-yl)ethyl)-, (R-(R*,R*))-2,3-dihydroxybutanedioate (salt), hydrate (1:1:1)
RN: 61059-59-4
InChIKey: NCNGCQCSDSBVCI-LREBCSMRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H17-N3-O2.C4-H6-O6.H2-O

Molecular Weight

  • 397.3817
 
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Names and Synonyms

Synonym

  • 3-Amino-N-(2-(5-hydroxy-1H-indol-3-yl)ethyl)propanamide tartrate, hydrate

Systematic Name

  • Propanamide, 3-amino-N-(2-(5-hydroxy-1H-indol-3-yl)ethyl)-, (R-(R*,R*))-2,3-dihydroxybutanedioate (salt), hydrate (1:1:1)

Registry Numbers

CAS Registry Number

  • 61059-59-4

System Generated Number

  • 0061059594

Molecular Formulas

Molecular Formula

  • C13-H17-N3-O2.C4-H6-O6.H2-O

Molecular Formula Fragments

  • C13-H17-N3-O2
  • C4-H6-O6
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C13H17N3O2.C4H6O6/c14-5-3-13(18)15-6-4-9-8-16-12-2-1-10(17)7-11(9)12;5-1(3(7)8)2(6)4(9)10/h1-2,7-8,16-17H,3-6,14H2,(H,15,18);1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1

InChIKey

NCNGCQCSDSBVCI-LREBCSMRSA-N

Smiles

c1cc2c(cc1O)c(c[nH]2)CCNC(=O)CCN.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 80mg/kg (80mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
Soviet Journal of Bioorganic Chemistry Vol. 2, Pg. 524, 1976.