Isospiropachysine

17-[1-(dimethylamino)ethyl]-2',10,13-trimethylspiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,3'-isoindole]-1'-one

Also Known As: Spiropachysine|Isospiropachysine|(3R,5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-(dimethylamino)ethyl]-2',10,13-trimethylspiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,3'-isoindole]-1'-one|17-[1-(dimethylamino)ethyl]-2',10,13-trimethyl-spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,3'-isoindoline]-1'-one|17-[1-(dimethylamino)ethyl]-2',10,13-trimethylspiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,3'-isoindole]-1'-one|Spiro[3H-cyclopenta[a]phenanthrene-3,1'-[1H]isoindol]-3'(2'H)-one, 17-[1-(dimethylamino)ethyl]-1,2,4,5,6,7,8,9,10,11,12,13,14,15,16,17-hexadecahydro-2',10,13-trimethyl-

Molecular Formula	C31H46N2O
Molecular Weight	462.36102 g/mol
LogP	7.1
Topological Polar Surface Area	23.6 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	2
Exact Mass	462.36102
Monoisotopic Mass	462.36102
Heavy Atoms	34
Complexity	824.0

Chemical Identifiers

CAS Number	19587-41-8
SMILES	CC(C1CCC2C1(CCC3C2CCC4C3(CCC5(C4)C6=CC=CC=C6C(=O)N5C)C)C)N(C)C
InChIKey	SLGWGPQWJRVPAD-UHFFFAOYSA-N