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Substance Name: 1,3,8,12-Tetradecatetraen-5-one, 9,13-dimethyl-1-(4-hydroxy-3-methoxyphenyl)-
RN: 144055-29-8
InChIKey: PRGIBLMQZXWTBA-VDBHWXCFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H30-O3

Molecular Weight

  • 354.487
 
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Names and Synonyms

Synonym

  • 9,13-Dimethyl-1-(4-hydroxy-3-methoxyphenyl)-1,3,8,12-tetradecatetraen-5-one

Systematic Name

  • 1,3,8,12-Tetradecatetraen-5-one, 9,13-dimethyl-1-(4-hydroxy-3-methoxyphenyl)-

Registry Numbers

CAS Registry Number

  • 144055-29-8

System Generated Number

  • 0144055298

Structure Descriptors

InChI

1S/C23H30O3/c1-18(2)9-7-10-19(3)11-8-14-21(24)13-6-5-12-20-15-16-22(25)23(17-20)26-4/h5-6,9,11-13,15-17,25H,7-8,10,14H2,1-4H3/b12-5+,13-6+,19-11+

InChIKey

PRGIBLMQZXWTBA-VDBHWXCFSA-N

Smiles

CC(=CCC/C(=C/CCC(=O)/C=C/C=C/c1ccc(c(c1)OC)O)/C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 500mg/kg (500mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #92-202133,