rel-(2R,4R,4aS,5R,7S,7aR,8R)-Hexahydro-4-methoxy-8-methyl-7a-(1-piperidinylmethyl)-2,5-methanocyclopenta-1,3-dioxin-7-ol
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rel-(2R,4R,4aS,5R,7S,7aR,8R)-Hexahydro-4-methoxy-8-methyl-7a-(1-piperidinylmethyl)-2,5-methanocyclopenta-1,3-dioxin-7-ol
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CAS No:
64860-67-9
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Formula:
C16H27NO4
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Chemical Name:
rel-(2R,4R,4aS,5R,7S,7aR,8R)-Hexahydro-4-methoxy-8-methyl-7a-(1-piperidinylmethyl)-2,5-methanocyclopenta-1,3-dioxin-7-ol
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Synonyms:
2,5-Methanocyclopenta-1,3-dioxin-7-ol,hexahydro-4-methoxy-8-methyl-7a-(1-piperidinylmethyl)-,(2R,4R,4aS,5R,7S,7aR,8R)-rel-;2,5-Methanocyclopenta-1,3-dioxin-7-ol,hexahydro-4-methoxy-8-methyl-7a-(1-piperidinylmethyl)-,(2α,4α,4aβ,5α,7β,7aβ,8R*)-;rel-(2R,4R,4aS,5R,7S,7aR,8R)-Hexahydro-4-methoxy-8-methyl-7a-(1-piperidinylmethyl)-2,5-methanocyclopenta-1,3-dioxin-7-ol;Valperinol;GA 30-905
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CAS No:
rel-(2R,4R,4aS,5R,7S,7aR,8R)-Hexahydro-4-methoxy-8-methyl-7a-(1-piperidinylmethyl)-2,5-methanocyclopenta-1,3-dioxin-7-ol Basic Attributes
297.39000
297.39
Drug Information
3-piperidinomethyl-4-hydroxy-8-methoxy-10-methyl-2,9-dioxatricyclo(4,3,1,0(3,7))decane
Computed Properties
Molecular Weight:297.39
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:297.19400834
Monoisotopic Mass:297.19400834
Topological Polar Surface Area:51.2
Heavy Atom Count:21
Complexity:400
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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