[(3R,4aS,5R,6R,6aR,10R,10aS,10bR)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] 4-(4-methylpiperazin-1-yl)butanoate
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![[(3R,4aS,5R,6R,6aR,10R,10aS,10bR)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] 4-(4-methylpiperazin-1-yl)butanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d54dd7046aa64fc4bbb87c04ed614cca.png "[(3R,4aS,5R,6R,6aR,10R,10aS,10bR)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] 4-(4-methylpiperazin-1-yl)butanoate")
[(3R,4aS,5R,6R,6aR,10R,10aS,10bR)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] 4-(4-methylpiperazin-1-yl)butanoate
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CAS No:
110452-75-0
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Formula:
C29H48N2O7
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Chemical Name:
[(3R,4aS,5R,6R,6aR,10R,10aS,10bR)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] 4-(4-methylpiperazin-1-yl)butanoate
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Synonyms:
7-beta-(gamma-(N'-methylpiperazino)-butyryloxy)-7-desacetylforskolin;7-desacetyl-7-(gamma-N-methylpiperazino)butyrylforskolin;7-MPB-forskolin;7B-forskolin;DMPB-forskolin;L 858051;L-858051;L858051;Dmpb-forskolin;110452-75-0;7-Mpb-forskolin;7B-Forskolin;L 858051;L858051;7-Desacetyl-7-(gamma-N-methylpiperazino)butyrylforskolin;DTXSID40911686;7-beta-(gamma-(N'-Methylpiperazino)-butyryloxy)-7-desacetylforskolin;1-Piperazinebutanoic acid, 4-methyl-, 3-ethenyldodecahydro-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-1H-naphtho(2,1-b)pyran-5-yl ester, (3R-(3alpha,4abeta,5beta,6beta,6aalpha,10alpha,10abeta,10balpha))-;3-Ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxododecahydro-1H-naphtho[2,1-b]pyran-5-yl 4-(4-methylpiperazin-1-yl)butanoate
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CAS No:
[(3R,4aS,5R,6R,6aR,10R,10aS,10bR)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] 4-(4-methylpiperazin-1-yl)butanoate Basic Attributes
536.7 g/mol
536.34615187 g/mol
Computed Properties
Molecular Weight:536.7
XLogP3:1.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:536.34615187
Monoisotopic Mass:536.34615187
Topological Polar Surface Area:120
Heavy Atom Count:38
Complexity:949
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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