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Substance Name: 1-alpha-H,5-alpha-H-Tropan-2-alpha-ol, 4-oxo-4H-1-benzopyran-2-carboxylate (ester), (+)-
RN: 87395-53-7
InChIKey: TVDBTMAYKPTBJX-RYCVTPFZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H19-N-O4

Molecular Weight

  • 313.3511
 
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Names and Synonyms

Synonyms

  • (+)-2-alpha-Tropanyl chromone-2-carboxylate
  • BRN 5596228

Systematic Name

  • 1-alpha-H,5-alpha-H-Tropan-2-alpha-ol, 4-oxo-4H-1-benzopyran-2-carboxylate (ester), (+)-

Registry Numbers

CAS Registry Number

  • 87395-53-7

System Generated Number

  • 0087395537

Structure Descriptors

InChI

1S/C18H19NO4/c1-19-11-6-8-13(19)16(9-7-11)23-18(21)17-10-14(20)12-4-2-3-5-15(12)22-17/h2-5,10-11,13,16H,6-9H2,1H3/t11?,13-,16?/m1/s1

InChIKey

TVDBTMAYKPTBJX-RYCVTPFZSA-N

Smiles

CN1[C@@H]2CCC1CCC2OC(=O)c3cc(=O)c4ccccc4o3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100mg/kg (100mg/kg)   Journal of Medicinal Chemistry. Vol. 26, Pg. 1772, 1983.