 Home > Encyclopedia > (3S,3aS,9S,9aS)-9-(4-hydroxy-3-methoxyphenyl)-6-methoxy-3,4,9,9a-tetrahydro-1H-benzo[f][2]benzofuran-3,3a,7-triol

(3S,3aS,9S,9aS)-9-(4-hydroxy-3-methoxyphenyl)-6-methoxy-3,4,9,9a-tetrahydro-1H-benzo[f][2]benzofuran-3,3a,7-triol

(3S,3aS,9S,9aS)-9-(4-hydroxy-3-methoxyphenyl)-6-methoxy-3,4,9,9a-tetrahydro-1H-benzo[f][2]benzofuran-3,3a,7-triol structure

CAS No:
73340-43-9
Formula:
C20H22O7
Chemical Name:
(3S,3aS,9S,9aS)-9-(4-hydroxy-3-methoxyphenyl)-6-methoxy-3,4,9,9a-tetrahydro-1H-benzo[f][2]benzofuran-3,3a,7-triol
Synonyms:
Africanal;NSC381277;73340-43-9;(+)-Africanal;AFRICANAL, (+);CHEMBL1994595;DTXSID30321775;NSC-381277;(3S,3aS,9S,9aS)-9-(4-hydroxy-3-methoxyphenyl)-6-methoxy-3,4,9,9a-tetrahydro-1H-benzo[f][2]benzofuran-3,3a,7-triol;NCI60_003613

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(3S,3aS,9S,9aS)-9-(4-hydroxy-3-methoxyphenyl)-6-methoxy-3,4,9,9a-tetrahydro-1H-benzo[f][2]benzofuran-3,3a,7-triol Basic Attributes

Molecular Weight：

374.4 g/mol

Exact Mass：

374.13655304 g/mol

NSC Number：

381277

DSSTox ID：

DTXSID30321775

Characteristics

PSA：

109 Å²

Computed Properties

Molecular Weight:374.4
XLogP3:1.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:374.13655304
Monoisotopic Mass:374.13655304
Topological Polar Surface Area:109
Heavy Atom Count:27
Complexity:531
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (3S,3aS,9S,9aS)-9-(4-hydroxy-3-methoxyphenyl)-6-methoxy-3,4,9,9a-tetrahydro-1H-benzo[f][2]benzofuran-3,3a,7-triol

Basic Attributes
Characteristics
Computed Properties

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