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Substance Name: 7-Ketolyoniol B
RN: 35316-30-4
InChIKey: AMKGWZFHNATSPK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H30-O6

Molecular Weight

  • 366.451
 
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Names and Synonyms

Results Name

  • 7-Ketolyoniol B

Synonym

  • 7-Ketolyoniol B

Systematic Name

  • 5,7a-Methano-7aH-cyclohept(6,7)azuleno(1,2-b)oxiren-8(1aH)-one, dodecahydro-2,6,9,9a-tetrahydroxy-2,6,10,10-tetramethyl-, (1aS-(1a-alpha,1b-alpha,2-alpha,2a-beta,5-alpha,6-alpha,7a-alpha,9-beta,9a-beta,10a-alpha))-

Registry Numbers

CAS Registry Number

  • 35316-30-4

System Generated Number

  • 0035316304

Structure Descriptors

InChI

1S/C20H30O6/c1-16(2)15-11(26-15)12-18(4,24)10-6-5-9-7-19(10,8-17(9,3)23)13(21)14(22)20(12,16)25/h9-12,14-15,22-25H,5-8H2,1-4H3

InChIKey

AMKGWZFHNATSPK-UHFFFAOYSA-N

Smiles

C1[C@@]([C@@H]2CC[C@@H]3[C@@]([C@@H]4[C@@H]5[C@@H](C([C@@]4([C@@H](C([C@@]13C2)=O)O)O)(C)C)O5)(C)O)(C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 5200ug/kg (5.2mg/kg) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

CARDIAC: ARRHYTHMIAS (INCLUDING CHANGES IN CONDUCTION)
Chemical and Pharmaceutical Bulletin. Vol. 22, Pg. 884, 1974.