 Home > Encyclopedia > 5-Hydroxy-2-({(2R,3R,8S,9R,11R)-3,9,11-trimethyl-8-[(2S)-1-oxo-1- (1H-pyrrol-2-yl)-2-propanyl]-1,7-dioxaspiro[5.5]undec-2-yl}methyl )-1,3-benzoxazole-4-carboxylic acid

5-Hydroxy-2-({(2R,3R,8S,9R,11R)-3,9,11-trimethyl-8-[(2S)-1-oxo-1- (1H-pyrrol-2-yl)-2-propanyl]-1,7-dioxaspiro[5.5]undec-2-yl}methyl )-1,3-benzoxazole-4-carboxylic acid

5-Hydroxy-2-({(2R,3R,8S,9R,11R)-3,9,11-trimethyl-8-[(2S)-1-oxo-1- (1H-pyrrol-2-yl)-2-propanyl]-1,7-dioxaspiro[5.5]undec-2-yl}methyl )-1,3-benzoxazole-4-carboxylic acid structure

CAS No:
104414-30-4
Formula:
C28H34N2O7
Chemical Name:
5-Hydroxy-2-({(2R,3R,8S,9R,11R)-3,9,11-trimethyl-8-[(2S)-1-oxo-1- (1H-pyrrol-2-yl)-2-propanyl]-1,7-dioxaspiro[5.5]undec-2-yl}methyl )-1,3-benzoxazole-4-carboxylic acid

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5-Hydroxy-2-({(2R,3R,8S,9R,11R)-3,9,11-trimethyl-8-[(2S)-1-oxo-1- (1H-pyrrol-2-yl)-2-propanyl]-1,7-dioxaspiro[5.5]undec-2-yl}methyl )-1,3-benzoxazole-4-carboxylic acid Basic Attributes

Molecular Weight：

510.57900

Exact Mass：

510.23660143 g/mol

Characteristics

PSA：

134.88000

XLogP3：

5.19370

Density：

1.34g/cm3

Boiling Point：

696.4ºC

Flash Point：

375ºC

Refractive Index：

1.624

Vapor Pressure：

2.33E-20mmHg at 25°C

Drug Information

MeSH Entry Terms：

3-hydroxycezomycin

Computed Properties

Molecular Weight:510.6
XLogP3:5.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:510.23660143
Monoisotopic Mass:510.23660143
Topological Polar Surface Area:135
Heavy Atom Count:37
Complexity:856
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Hydroxy-2-({(2R,3R,8S,9R,11R)-3,9,11-trimethyl-8-[(2S)-1-oxo-1- (1H-pyrrol-2-yl)-2-propanyl]-1,7-dioxaspiro[5.5]undec-2-yl}methyl )-1,3-benzoxazole-4-carboxylic acid

Basic Attributes
Characteristics
Drug Information
Computed Properties

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