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Substance Name: Diisobutyrylapomorphine
RN: 42337-29-1
InChIKey: VNUZLUGZUNVCTB-LJQANCHMSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H29-N-O4

Molecular Weight

  • 407.5071
 
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Names and Synonyms

Results Name

  • Diisobutyrylapomorphine

Synonyms

  • (R)-6-Methyl-5,6,6a,7-tetrahydro-4H-dibenzo(de,g)quinoline-10,11-diyl 2-methylpropionate
  • Diisobutyrylapomorphine

Systematic Name

  • Propanoic acid, 2-methyl-, 5,6,6a,7-tetrahydro-6-methyl-4H-dibenzo(de,g)quinoline-10,11-diyl ester, (R)-

Registry Numbers

CAS Registry Number

  • 42337-29-1

System Generated Number

  • 0042337291

Structure Descriptors

InChI

1S/C25H29NO4/c1-14(2)24(27)29-20-10-9-17-13-19-21-16(11-12-26(19)5)7-6-8-18(21)22(17)23(20)30-25(28)15(3)4/h6-10,14-15,19H,11-13H2,1-5H3/t19-/m1/s1

InChIKey

VNUZLUGZUNVCTB-LJQANCHMSA-N

Smiles

CC(C)C(=O)Oc1ccc2c(c1OC(=O)C(C)C)-c3cccc4c3[C@@H](C2)N(CC4)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 800mg/kg (800mg/kg)   United States Patent Document. Vol. #4080456,