 Home > Encyclopedia > (1S,4R,5R,7S)-6-(3,4-dimethoxyphenyl)-4-hydroxy-3-methoxy-4,7-dimethyl-1-prop-2-enylbicyclo[3.2.1]oct-2-en-8-one

(1S,4R,5R,7S)-6-(3,4-dimethoxyphenyl)-4-hydroxy-3-methoxy-4,7-dimethyl-1-prop-2-enylbicyclo[3.2.1]oct-2-en-8-one

(1S,4R,5R,7S)-6-(3,4-dimethoxyphenyl)-4-hydroxy-3-methoxy-4,7-dimethyl-1-prop-2-enylbicyclo[3.2.1]oct-2-en-8-one structure

CAS No:
108864-50-2
Formula:
C22H28O5
Chemical Name:
(1S,4R,5R,7S)-6-(3,4-dimethoxyphenyl)-4-hydroxy-3-methoxy-4,7-dimethyl-1-prop-2-enylbicyclo[3.2.1]oct-2-en-8-one
Synonyms:
1'-allyl-7-(3,4-dimethoxyphenyl)-4'-hydroxy-5'-methoxy-8-methyl-2'-oxobicyclo (3.2.1) oct-5'-ene;hancinol;Hancinol;108864-50-2;DTXSID80910890;(1R,2R,5S,6S)-7-(3,4-dimethoxyphenyl)-2-hydroxy-3-methoxy-2,6-dimethyl-5-prop-2-enylbicyclo[3.2.1]oct-3-en-8-one;1'-Allyl-7-(3,4-dimethoxyphenyl)-4'-hydroxy-5'-methoxy-8-methyl-2'-oxobicyclo(3.2.1)oct-5'-ene;6-(3,4-Dimethoxyphenyl)-4-hydroxy-3-methoxy-4,7-dimethyl-1-(prop-2-en-1-yl)bicyclo[3.2.1]oct-2-en-8-one;Bicyclo(3.2.1)oct-2-en-8-one, 6-(3,4-dimethoxyphenyl)-4-hydroxy-3-methoxy-4,7-dimethyl-1-(2-propenyl)-, (4-endo,6-exo,7-endo)-(+)-
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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(1S,4R,5R,7S)-6-(3,4-dimethoxyphenyl)-4-hydroxy-3-methoxy-4,7-dimethyl-1-prop-2-enylbicyclo[3.2.1]oct-2-en-8-one Basic Attributes

Molecular Weight：

372.5 g/mol

Exact Mass：

372.19367399 g/mol

Characteristics

PSA：

65 Å²

Drug Information

MeSH Entry Terms：

1'-allyl-7-(3,4-dimethoxyphenyl)-4'-hydroxy-5'-methoxy-8-methyl-2'-oxobicyclo (3.2.1) oct-5'-ene

Computed Properties

Molecular Weight:372.5
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:372.19367399
Monoisotopic Mass:372.19367399
Topological Polar Surface Area:65
Heavy Atom Count:27
Complexity:628
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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(1s,4r,5r,7s)-6-(3,4-dimethoxyphenyl)-4-hydroxy-3-methoxy-4,7-dimethyl-1-prop-2-enylbicyclo[3.2.1]oct-2-en-8-one

CAS No.: 108864-50-2

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Guide of (1S,4R,5R,7S)-6-(3,4-dimethoxyphenyl)-4-hydroxy-3-methoxy-4,7-dimethyl-1-prop-2-enylbicyclo[3.2.1]oct-2-en-8-one

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