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Substance Name: alpha-Cedrene epoxide
RN: 29597-36-2
InChIKey: HZRFVTRTTXBHSE-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C15-H24-O

Molecular Weight

  • 220.354
 
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Names and Synonyms

Results Name

  • alpha-Cedrene epoxide

Synonyms

  • AI3-36592
  • alpha-Cedrene epoxide
  • Andrane
  • Cedr-8-ene epoxide
  • EINECS 249-717-2
  • NSC 371728

Systematic Names

  • 2H-2a,7-Methanoazuleno(5,6-b)oxirene, octahydro-3,6,6,7a-tetramethyl-
  • Cedrane, 8,9-epoxide
  • Octahydro-3,6,6,7a-tetramethyl-2H-2a,7-methanoazuleno(5,6-b)oxirene

Registry Numbers

CAS Registry Number

  • 29597-36-2

System Generated Number

  • 0029597362

Structure Descriptors

InChI

1S/C15H24O/c1-9-5-6-10-13(2,3)11-7-15(9,10)8-12-14(11,4)16-12/h9-12H,5-8H2,1-4H3

InChIKey

HZRFVTRTTXBHSE-UHFFFAOYSA-N

Smiles

O1[C@@]2([C@@H]3C[C@@]4([C@@H](CC[C@@H]4C)C3(C)C)C[C@@H]12)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 18, Pg. 663, 1980.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 18, Pg. 663, 1980.