 Home > Encyclopedia > 1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,6,8-trihydroxy-5-[(E)-4-hydroxy-3-methylbut-2-enyl]-2-methoxyxanthen-9-one

1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,6,8-trihydroxy-5-[(E)-4-hydroxy-3-methylbut-2-enyl]-2-methoxyxanthen-9-one

1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,6,8-trihydroxy-5-[(E)-4-hydroxy-3-methylbut-2-enyl]-2-methoxyxanthen-9-one structure

CAS No:
105742-85-6
Formula:
C29H34O7
Chemical Name:
1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,6,8-trihydroxy-5-[(E)-4-hydroxy-3-methylbut-2-enyl]-2-methoxyxanthen-9-one
Synonyms:
Isocowanol;

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1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,6,8-trihydroxy-5-[(E)-4-hydroxy-3-methylbut-2-enyl]-2-methoxyxanthen-9-one Basic Attributes

Molecular Weight：

494.57600

Exact Mass：

494.23045342

Characteristics

PSA：

120.36000

XLogP3：

5.78790

Density：

1.243g/cm3

Boiling Point：

708.7ºC

Flash Point：

232.1ºC

Refractive Index：

1.616

Vapor Pressure：

4.43E-21mmHg at 25°C

Drug Information

MeSH Entry Terms：

isocowanol

Computed Properties

Molecular Weight:494.6
XLogP3:6.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:494.23045342
Monoisotopic Mass:494.23045342
Topological Polar Surface Area:116
Heavy Atom Count:36
Complexity:843
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,6,8-trihydroxy-5-[(E)-4-hydroxy-3-methylbut-2-enyl]-2-methoxyxanthen-9-one

Basic Attributes
Characteristics
Drug Information
Computed Properties

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