1-[[(1R,7aS)-Hexahydro-1H-pyrrolizin-1-yl]methyl] 4-methyl (2R)-2-hydroxy-2-(phenylmethyl)butanedioate
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1-[[(1R,7aS)-Hexahydro-1H-pyrrolizin-1-yl]methyl] 4-methyl (2R)-2-hydroxy-2-(phenylmethyl)butanedioate
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CAS No:
23412-97-7
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Formula:
C20H27NO5
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Chemical Name:
1-[[(1R,7aS)-Hexahydro-1H-pyrrolizin-1-yl]methyl] 4-methyl (2R)-2-hydroxy-2-(phenylmethyl)butanedioate
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Synonyms:
Butanedioic acid,2-hydroxy-2-(phenylmethyl)-,1-[[(1R,7aS)-hexahydro-1H-pyrrolizin-1-yl]methyl] 4-methyl ester,(2R)-;Phalenopsine T;Butanedioic acid,2-hydroxy-2-(phenylmethyl)-,1-[(hexahydro-1H-pyrrolizin-1-yl)methyl] 4-methyl ester,[1R-[1α(R*),7aα]]-;1-[[(1R,7aS)-Hexahydro-1H-pyrrolizin-1-yl]methyl] 4-methyl (2R)-2-hydroxy-2-(phenylmethyl)butanedioate;Phalaenopsine T;T-Phalaenopsine;Phalaenopsine;11046-53-0
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CAS No:
1-[[(1R,7aS)-Hexahydro-1H-pyrrolizin-1-yl]methyl] 4-methyl (2R)-2-hydroxy-2-(phenylmethyl)butanedioate Basic Attributes
361.4 g/mol
361.43
DTXSID90331936
Computed Properties
Molecular Weight:361.4
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:361.18892296
Monoisotopic Mass:361.18892296
Topological Polar Surface Area:76.1
Heavy Atom Count:26
Complexity:504
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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