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Substance Name: (+)-Ochotensine
RN: 4959-88-0
InChIKey: MDAWGFZRYVVBAS-UHFFFAOYSA-N

Classification Code

  • Natural Product

Molecular Formula

  • C21-H21-N-O4

Molecular Weight

  • 351.4
 
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Names and Synonyms

Results Name

  • (+)-Ochotensine

Synonym

  • Ochotensine

Systematic Name

  • Spiro(7H-indeno(4,5-d)-1,3-dioxole-7,1'(2'H)-isoquinolin)-6'-ol, 3',4',6,8-tetrahydro-7'-methoxy-2'-methyl-6-methylene-, (S)-

Registry Numbers

CAS Registry Number

  • 4959-88-0

System Generated Number

  • 0004959880

Structure Descriptors

InChI

1S/C21H21NO4/c1-12-14-4-5-18-20(26-11-25-18)15(14)10-21(12)16-9-19(24-3)17(23)8-13(16)6-7-22(21)2/h4-5,8-9,23H,1,6-7,10-11H2,2-3H3

InChIKey

MDAWGFZRYVVBAS-UHFFFAOYSA-N

Smiles

C1c2cc(c(cc2[C@@]2(C(c3c(C2)c2c(cc3)OCO2)=C)[N@@](C1)C)OC)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 10600ug/kg (10.6mg/kg)   Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 5, Pg. 163, 1946.