Equisetin

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Names

[ CAS No. ]:
57749-43-6

[ Name ]:
Equisetin

[Synonym ]:
Equisetin

Chemical & Physical Properties

[ Density]:
1.187 g/cm3

[ Boiling Point ]:
513.6ºC at 760 mmHg

[ Molecular Formula ]:
C22H31NO4

[ Molecular Weight ]:
373.48600

[ Flash Point ]:
264.4ºC

[ Exact Mass ]:
373.22500

[ PSA ]:
77.84000

[ LogP ]:
2.95920

[ Index of Refraction ]:
1.587

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KD7986000
CHEMICAL NAME :
Equisetin
CAS REGISTRY NUMBER :
57749-43-6
LAST UPDATED :
199403
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C22-H31-N-O4
MOLECULAR WEIGHT :
373.54

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
63 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AMACCQ Antimicrobial Agents and Chemotherapy. (American Soc. for Microbiology, 1913 I St., NW, Washington, DC 20006) V.1- 1972- Volume(issue)/page/year: 5,634,1974

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • methylN-(3-((1S,2R,4aS,6R,8aR)-1,6-dimethyl-2-((E)-prop-1-en-1-yl)-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)-3-oxopropanoyl)-N-methyl-L-serinate
  • ((1S,2R,4aS,6R,8aR)-1,6-dimethyl-2-((E)-prop-1-en-1-yl)-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methanol
  • (1S,2R,4aS,6R,8aR)-1,6-dimethyl-2-((E)-prop-1-en-1-yl)-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carbaldehyde
  • 2,4-Hexadienal
  • (+)-dihydrocarvone
  • (1S,8Ξ)-2-oxo-trans-p-menthan-9-oic acid
  • (2R,4aR,5S,6R,8aS)-5-(hydroxymethyl)-2,5-dimethyl-6-((E)-prop-1-en-1-yl)-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-ol
  • (1S,4aR,7R,8aR)-4,7-dimethyl-1-((1E,3E)-penta-1,3-dien-1-yl)tetrahydro-1H-isochromene-3,8(4H,8aH)-dione
  • (1S,2R,4aS,6R,8aR)-1,6-dimethyl-5-oxo-2-((E)-prop-1-en-1-yl)-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylic acid

DownStream