 Home > Encyclopedia > (3aS,4S,9R,9aR)-4-(4-fluoroanilino)-6,7-dihydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-3a,4,9,9a-tetrahydro-3H-benzo[f][2]benzofuran-1-one

(3aS,4S,9R,9aR)-4-(4-fluoroanilino)-6,7-dihydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-3a,4,9,9a-tetrahydro-3H-benzo[f][2]benzofuran-1-one

(3aS,4S,9R,9aR)-4-(4-fluoroanilino)-6,7-dihydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-3a,4,9,9a-tetrahydro-3H-benzo[f][2]benzofuran-1-one structure

CAS No:
138355-88-1
Formula:
C26H24FNO7
Chemical Name:
(3aS,4S,9R,9aR)-4-(4-fluoroanilino)-6,7-dihydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-3a,4,9,9a-tetrahydro-3H-benzo[f][2]benzofuran-1-one
Synonyms:
138355-88-1;(3aS-(3aalpha,4beta,9alpha,9abeta))-4-((4-fluorophenyl)amino)-3a,4,9,9a-tetrahydro-6,7-dihydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)naphtho(2,3-c)furan-1(3H)-one;CHEMBL318276;DTXSID20160635;(3aS)-3abeta,4,9,9aalpha-Tetrahydro-6,7-dihydroxy-4alpha-(4-fluorophenylamino)-9beta-(4-hydroxy-3,5-dimethoxyphenyl)naphtho[2,3-c]furan-1(3H)-one;(3aS,4S,9R,9aR)-4-(4-fluoroanilino)-6,7-dihydroxy-9-(4-hydroxy-3,5-dimethoxy-phenyl)-3a,4,9,9a-tetrahydro-3H-benzo[f]isobenzofuran-1-one;Naphtho[2,3-c]furan-1(3H)-one, 4-[(4-fluorophenyl)amino]-3a,4,9,9a-tetrahydro-6,7-dihydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-, [3aS-(3a.alpha.,4.beta.,9.alpha.,9a.beta.)]-

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(3aS,4S,9R,9aR)-4-(4-fluoroanilino)-6,7-dihydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-3a,4,9,9a-tetrahydro-3H-benzo[f][2]benzofuran-1-one Basic Attributes

Molecular Weight：

481.5 g/mol

Exact Mass：

481.15368027 g/mol

DSSTox ID：

DTXSID20160635

Characteristics

PSA：

118 Å²

Computed Properties

Molecular Weight:481.5
XLogP3:3.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:481.15368027
Monoisotopic Mass:481.15368027
Topological Polar Surface Area:118
Heavy Atom Count:35
Complexity:735
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: carbon monoxide formula; lithium nitride; h3bo3; sodium acetate chemical formula; sulfur trioxide formula; lacunar stroke

Guide of (3aS,4S,9R,9aR)-4-(4-fluoroanilino)-6,7-dihydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-3a,4,9,9a-tetrahydro-3H-benzo[f][2]benzofuran-1-one

Basic Attributes
Characteristics
Computed Properties

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