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Substance Name: 2H-1-Benzopyran-5-ol, 3,4-dihydro-2,2-dimethyl-4-((2-hydroxypropyl)imino)-7-pentyl-, (R)-
RN: 88879-95-2
InChIKey: OKURTQCJMLLIAG-LKCUONQHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H29-N-O3

Molecular Weight

  • 319.4421
 
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Names and Synonyms

Synonym

  • (R)-3,4-Dihydro-2,2-dimethyl-4-((2-hydroxypropyl)imino)-7-pentyl-2H-1-benzopyran-5-ol

Systematic Name

  • 2H-1-Benzopyran-5-ol, 3,4-dihydro-2,2-dimethyl-4-((2-hydroxypropyl)imino)-7-pentyl-, (R)-

Registry Numbers

CAS Registry Number

  • 88879-95-2

System Generated Number

  • 0088879952

Structure Descriptors

InChI

1S/C19H29NO3/c1-5-6-7-8-14-9-16(22)18-15(20-12-13(2)21)11-19(3,4)23-17(18)10-14/h9-10,13,21-22H,5-8,11-12H2,1-4H3/b20-15-/t13-/m1/s1

InChIKey

OKURTQCJMLLIAG-LKCUONQHSA-N

Smiles

c12/C(=N\C[C@H](O)C)CC(Oc1cc(cc2O)CCCCC)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 33, Pg. 2865, 1990.