Cannabisativine

(13R,17R)-17-[(1R,2S)-1,2-dihydroxyheptyl]-1,5,10-triazabicyclo[11.4.0]heptadec-15-en-11-one

Also Known As: Cannabisativine|(+)-Cannabisativine|PBCMNNABISATIVINE|KST-1A6324|1,2-Dihydro-8-methoxy-2-oxo-5-quinolinecarboxaldehyde|(13r,16ar)-13-[(1r,2s)-1,2-dihydroxyheptyl]-1,4,5,6,7,8,9,10,11,13,16,16a-dodecahydropyrido[2,1-d][1,5,9]triazacyclotridecin-2(3h)-one|(13R,17R)-17-[(1R,2S)-1,2-dihydroxyheptyl]-1,5,10-triazabicyclo[11.4.0]heptadec-15-en-11-one|(13R,16aR)-13-[(1R,2S)-1,2-dihydroxyheptyl]-1H,2H,3H,4H,5H,6H,7H,8H,9H,10H,11H,13H,16H,16aH-pyrido[2,1-d]1,5,9-triazacyclotridecan-2-one|(13S,17S)-17-((1S,2R)-1,2-dihydroxyheptyl)-1,5,10-triazabicyclo(11.4.0)heptadec-15-en-11-one|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*)-(+)-|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*]-()-

Molecular Formula	C21H39N3O3
Molecular Weight	381.29913 g/mol
LogP	1.57
Topological Polar Surface Area	84.83 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	381.29913
Heavy Atoms	27
Complexity	458.0

Chemical Identifiers

CAS Number	57682-64-1
SMILES	CCCCC[C@@H]([C@@H]([C@H]1C=CC[C@H]2N1CCCNCCCCNC(=O)C2)O)O