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Substance Name: Cannabisativine
RN: 57682-64-1
InChIKey: KZZKPJBKEJKNAK-WERVVEIQSA-N

Note

  • Alkaloid from Cannabis sativa root.

Molecular Formula

  • C21-H39-N3-O3

Molecular Weight

  • 381.557
 
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Names and Synonyms

Name of Substance

  • Cannabisativine

Systematic Name

  • Pyrido(2,1-d)(1,5,9)triazacyclotridecin-2(3H)-one, 13-(1,2-dihydroxyheptyl)-1,4,5,6,7,8,9,10,11,13,16,16a-dodecahydro-, (13R*(1R*,2S*),16aR*)-(+)-

Registry Numbers

CAS Registry Number

  • 57682-64-1

System Generated Number

  • 0057682641

Structure Descriptors

InChI

1S/C21H39N3O3/c1-2-3-4-11-19(25)21(27)18-10-7-9-17-16-20(26)23-14-6-5-12-22-13-8-15-24(17)18/h7,10,17-19,21-22,25,27H,2-6,8-9,11-16H2,1H3,(H,23,26)/t17-,18-,19+,21-/m1/s1

InChIKey

KZZKPJBKEJKNAK-WERVVEIQSA-N

Smiles

C1(=O)NCCCCNCCC[N@@]2[C@H](C=CC[C@H]2C1)[C@H]([C@H](CCCCC)O)O