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Substance Name: Myristicin
RN: 607-91-0
UNII: 04PD6CT78W
InChIKey: BNWJOHGLIBDBOB-UHFFFAOYSA-N

Note

  • Asaricin is an isomer; a methylene dioxy version of elemicin.

Molecular Formula

  • C11-H12-O3

Molecular Weight

  • 192.2128
 

Classification Codes

  • Human Data
  • Mutation Data
  • Tumor Data
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Names and Synonyms

Name of Substance

  • Myristicin

Synonyms

  • 1,3-Benzodioxole, 4-methoxy-6-(2-propenyl)-
  • 4-Methoxy-6-(2-propenyl)-1,3-benzodioxole
  • 5-19-02-00631 (Beilstein Handbook Reference)
  • 5-Allyl-1-methoxy-2,3-(methylenedioxy)benzene
  • 6-Allyl-4-methoxy-1,3-benzodioxole
  • Benzene, 5-allyl-1-methoxy-2,3-(methylenedioxy)-
  • BRN 0166218
  • CCRIS 6782
  • EINECS 210-146-9
  • HSDB 3516
  • Myristicin
  • Myristicin (6CI)
  • UNII-04PD6CT78W

Systematic Names

  • 1,3-Benzodioxole, 4-methoxy-6-(2-propenyl)- (9CI)
  • 6-Allyl-4-methoxy-1,3-benzodioxole
  • Benzene, 5-allyl-1-methoxy-2,3-(methylenedioxy)-
  • Myristicin

Registry Numbers

CAS Registry Number

  • 607-91-0

FDA UNII

  • 04PD6CT78W

System Generated Number

  • 0000607910

Structure Descriptors

InChI

1S/C11H12O3/c1-3-4-8-5-9(12-2)11-10(6-8)13-7-14-11/h3,5-6H,1,4,7H2,2H3

InChIKey

BNWJOHGLIBDBOB-UHFFFAOYSA-N

Smiles

COc1cc(CC=C)cc2OCOc12

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LDLo oral 400mg/kg (400mg/kg) LIVER: FATTY LIVER DEGERATION

BEHAVIORAL: GENERAL ANESTHETIC
American Journal of Pharmacy Vol. 80, Pg. 563, 1909.
guinea pig LDLo subcutaneous 2gm/kg (2000mg/kg) LIVER: OTHER CHANGES

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS
American Journal of Pharmacy Vol. 80, Pg. 563, 1909.
human TDLo oral 5700ug/kg (5.7mg/kg) BEHAVIORAL: EUPHORIA

BEHAVIORAL: WAKEFULNESS

BEHAVIORAL: "HALLUCINATIONS, DISTORTED PERCEPTIONS"
Journal of Neuropsychiatry. Vol. 2, Pg. 205, 1961.
rabbit LDLo subcutaneous 900mg/kg (900mg/kg)   American Journal of Pharmacy Vol. 80, Pg. 563, 1909.
rabbit LDLo subcutaneous 900mg/kg (900mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

LIVER: OTHER CHANGES
American Journal of Pharmacy Vol. 80, Pg. 563, 1909.
rat LD50 oral 4260mg/kg (4260mg/kg)   Journal of Agricultural and Food Chemistry. Vol. 30, Pg. 563, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -2.00E+01 deg C   EXP
Boiling Point 276.5 deg C   EXP
log P (octanol-water) 3.530 (none)   EST
Water Solubility 46.4 mg/L 25 EST
Henry's Law Constant 5.37E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.30E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.