 Home > Encyclopedia > (5S,5aS,8aR,9R)-5-[2-(diethylamino)ethylamino]-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one

(5S,5aS,8aR,9R)-5-[2-(diethylamino)ethylamino]-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one

(5S,5aS,8aR,9R)-5-[2-(diethylamino)ethylamino]-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one structure

CAS No:
201594-14-1
Formula:
C27H34N2O7
Chemical Name:
(5S,5aS,8aR,9R)-5-[2-(diethylamino)ethylamino]-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one
Synonyms:
201594-14-1;Furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one, 9-((2-(diethylamino)ethyl)amino)-5,8,8a,9-tetrahydro-5-(4-hydroxy-3,5-dimethoxyphenyl)-, (5R-(5alpha,5abeta,8aalpha,9beta))-;CHEMBL98908;DTXSID40173984;8-(((Diethylamino)methyl)amino)-2-(4-hydroxy-3,5-dimethoxyphenyl)-5,12,14-trioxatetracyclo(7(7.0.0(3,7).0(11,15))hexadeca-1(16),9(10),11(15)-trien-4-one;(5S,5aS,8aR,9R)-5-(2-diethylaminoethylamino)-9-(4-hydroxy-3,5-dimethoxy-phenyl)-5a,6,8a,9-tetrahydro-5H-isobenzofuro[6,5-f][1,3]benzodioxol-8-one;8-(((Diethylamino)methyl)amino)-2-(4-hydroxy-3,5-dimethoxyphenyl)-5,12,14-trioxatetracyclo[7.7.0.0<3,7>.0<11,15>]hexadeca-1(16),9(10),11(15)-trien-4-one;Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 9-[[2-(diethylamino)ethyl]amino]-5,8,8a,9-tetrahydro-5-(4-hydroxy-3,5-dimethoxyphenyl)-, [5R-(5.alpha.,5a.beta.,8a.alpha.,9.beta.)]-

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(5S,5aS,8aR,9R)-5-[2-(diethylamino)ethylamino]-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one Basic Attributes

Molecular Weight：

498.6 g/mol

Exact Mass：

498.23660143 g/mol

DSSTox ID：

DTXSID40173984

Characteristics

PSA：

98.7 Å²

Computed Properties

Molecular Weight:498.6
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:9
Exact Mass:498.23660143
Monoisotopic Mass:498.23660143
Topological Polar Surface Area:98.7
Heavy Atom Count:36
Complexity:738
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (5S,5aS,8aR,9R)-5-[2-(diethylamino)ethylamino]-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one

Basic Attributes
Characteristics
Computed Properties

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