 Home > Encyclopedia > 2-[(1E,5E,7E,11E)-3-hydroxy-3,7,9,11-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytrideca-1,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-1H-pyridin-4-one

2-[(1E,5E,7E,11E)-3-hydroxy-3,7,9,11-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytrideca-1,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-1H-pyridin-4-one

2-[(1E,5E,7E,11E)-3-hydroxy-3,7,9,11-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytrideca-1,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-1H-pyridin-4-one structure

CAS No:
125535-05-9
Formula:
C31H47NO10
Chemical Name:
2-[(1E,5E,7E,11E)-3-hydroxy-3,7,9,11-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytrideca-1,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-1H-pyridin-4-one
Synonyms:
Glucopiericidinol A2; Glucopiericidinol A1;
Categories:
Biochemical Engineering > Saccharides

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2-[(1E,5E,7E,11E)-3-hydroxy-3,7,9,11-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytrideca-1,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-1H-pyridin-4-one Basic Attributes

Molecular Weight：

593.70600

Exact Mass：

593.31999670

Characteristics

PSA：

171.19000

XLogP3：

2.55700

Density：

1.24g/cm3

Boiling Point：

834.1ºC at 760mmHg

Flash Point：

458.2ºC

Refractive Index：

1.577

Vapor Pressure：

2.72E-32mmHg at 25°C

Drug Information

MeSH Entry Terms：

glucopiericidinol A1|glucopiericidinol A2

Computed Properties

Molecular Weight:593.7
XLogP3:3
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:13
Exact Mass:593.31999670
Monoisotopic Mass:593.31999670
Topological Polar Surface Area:167
Heavy Atom Count:42
Complexity:1140
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(1E,5E,7E,11E)-3-hydroxy-3,7,9,11-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytrideca-1,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-1H-pyridin-4-one

Basic Attributes
Characteristics
Drug Information
Computed Properties
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