 Home > Encyclopedia > (2R,3S,3aS,7S,7aR)-2-(1,3-Benzodioxol-5-yl)-3,3a,7,7a-tetrahydro-3a,4-dimethoxy-3-methyl-7-(2-propen-1-yl)-6(2H)-benzofuranone

(2R,3S,3aS,7S,7aR)-2-(1,3-Benzodioxol-5-yl)-3,3a,7,7a-tetrahydro-3a,4-dimethoxy-3-methyl-7-(2-propen-1-yl)-6(2H)-benzofuranone

(2R,3S,3aS,7S,7aR)-2-(1,3-Benzodioxol-5-yl)-3,3a,7,7a-tetrahydro-3a,4-dimethoxy-3-methyl-7-(2-propen-1-yl)-6(2H)-benzofuranone structure

CAS No:
116424-69-2
Formula:
C21H24O6
Chemical Name:
(2R,3S,3aS,7S,7aR)-2-(1,3-Benzodioxol-5-yl)-3,3a,7,7a-tetrahydro-3a,4-dimethoxy-3-methyl-7-(2-propen-1-yl)-6(2H)-benzofuranone
Synonyms:
6(2H)-Benzofuranone,2-(1,3-benzodioxol-5-yl)-3,3a,7,7a-tetrahydro-3a,4-dimethoxy-3-methyl-7-(2-propen-1-yl)-,(2R,3S,3aS,7S,7aR)-;6(2H)-Benzofuranone,2-(1,3-benzodioxol-5-yl)-3,3a,7,7a-tetrahydro-3a,4-dimethoxy-3-methyl-7-(2-propenyl)-,[2R-(2α,3β,3aβ,7α,7aβ)]-;6(2H)-Benzofuranone,2-(1,3-benzodioxol-5-yl)-3,3a,7,7a-tetrahydro-3a,4-dimethoxy-3-methyl-7-(2-propenyl)-,(2R,3S,3aS,7S,7aR)-;(2R,3S,3aS,7S,7aR)-2-(1,3-Benzodioxol-5-yl)-3,3a,7,7a-tetrahydro-3a,4-dimethoxy-3-methyl-7-(2-propen-1-yl)-6(2H)-benzofuranone;Fargesone A
Categories:
Natural Products > Lignans

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Description

Fargesone A is a member of benzodioxoles.

(2R,3S,3aS,7S,7aR)-2-(1,3-Benzodioxol-5-yl)-3,3a,7,7a-tetrahydro-3a,4-dimethoxy-3-methyl-7-(2-propen-1-yl)-6(2H)-benzofuranone Basic Attributes

Molecular Weight：

372.41166

Exact Mass：

372.41

DSSTox ID：

DTXSID20331969

Characteristics

PSA：

63.22000

XLogP3：

3.76

Density：

1.25±0.1 g/cm3(Predicted)

Boiling Point：

508.0±50.0 °C(Predicted)

Flash Point：

222.0±30.2 °C

Refractive Index：

1.576

Drug Information

MeSH Entry Terms：

fargesone A

Computed Properties

Molecular Weight:372.4
XLogP3:2.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:372.15728848
Monoisotopic Mass:372.15728848
Topological Polar Surface Area:63.2
Heavy Atom Count:27
Complexity:630
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2R,3S,3aS,7S,7aR)-2-(1,3-Benzodioxol-5-yl)-3,3a,7,7a-tetrahydro-3a,4-dimethoxy-3-methyl-7-(2-propen-1-yl)-6(2H)-benzofuranone

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties
Learn More Other Chemicals

(2R,3S,3aS,7S,7aR)-2-(1,3-Benzodioxol-5-yl)-3,3a,7,7a-tetrahydro-3a,4-dimethoxy-3-methyl-7-(2-propen-1-yl)-6(2H)-benzofuranone

SDS

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