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Substance Name: 1H-Indole-3-ethanamine, N-(hexahydro-4,8a-dimethoxy-9-methylene-2,5-methano-4H-1,3-benzodioxin-7-yl)-, (2-alpha,4-alpha,4a-beta,5-alpha,7-alpha,8a-beta)-
RN: 98392-53-1
InChIKey: HEJGDXKZIRWMDZ-GRGRNVQASA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H28-N2-O4

Molecular Weight

  • 384.4732
 
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Names and Synonyms

  • 1H-Indole-3-ethanamine, N-(hexahydro-4,8a-dimethoxy-9-methylene-2,5-methano-4H-1,3-benzodioxin-7-yl)-, (2-alpha,4-alpha,4a-beta,5-alpha,7-alpha,8a-beta)-

Registry Numbers

CAS Registry Number

  • 98392-53-1

System Generated Number

  • 0098392531

Structure Descriptors

InChI

1S/C22H28N2O4/c1-13-17-10-15(11-22(26-3)19(17)21(25-2)27-20(13)28-22)23-9-8-14-12-24-18-7-5-4-6-16(14)18/h4-7,12,15,17,19-21,23-24H,1,8-11H2,2-3H3/t15-,17+,19-,20+,21-,22+/m1/s1

InChIKey

HEJGDXKZIRWMDZ-GRGRNVQASA-N

Smiles

CO[C@H]1[C@H]2[C@H]3C[C@H](C[C@@]2(O[C@@H](C3=C)O1)OC)NCCc4c[nH]c5c4cccc5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LDLo unreported 83263ug/kg (83.263mg/kg)   United States Patent Document. Vol. #4526991,