 Home > Encyclopedia > Milbemycin B, 5-O-demethyl-28-deoxy-6,28-epoxy-13-(2-methyl-1-oxopropoxy)-25-(1-methyl-1-propenyl)-, (6R,13R,25S)-

Milbemycin B, 5-O-demethyl-28-deoxy-6,28-epoxy-13-(2-methyl-1-oxopropoxy)-25-(1-methyl-1-propenyl)-, (6R,13R,25S)-

Milbemycin B, 5-O-demethyl-28-deoxy-6,28-epoxy-13-(2-methyl-1-oxopropoxy)-25-(1-methyl-1-propenyl)-, (6R,13R,25S)- structure

CAS No:
127346-86-5
Formula:
C38H54O9
Chemical Name:
Milbemycin B, 5-O-demethyl-28-deoxy-6,28-epoxy-13-(2-methyl-1-oxopropoxy)-25-(1-methyl-1-propenyl)-, (6R,13R,25S)-

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Milbemycin B, 5-O-demethyl-28-deoxy-6,28-epoxy-13-(2-methyl-1-oxopropoxy)-25-(1-methyl-1-propenyl)-, (6R,13R,25S)- Basic Attributes

Molecular Weight：

654.83000

Exact Mass：

654.37678330

Characteristics

PSA：

120.75000

XLogP3：

5.65820

Density：

1.2g/cm3

Boiling Point：

787.9ºC

Flash Point：

238.4ºC

Refractive Index：

1.568

Vapor Pressure：

1.09E-28mmHg at 25°C

Drug Information

MeSH Entry Terms：

UK 80695

Computed Properties

Molecular Weight:654.8
XLogP3:4.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:654.37678330
Monoisotopic Mass:654.37678330
Topological Polar Surface Area:121
Heavy Atom Count:47
Complexity:1360
Defined Atom Stereocenter Count:9
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Milbemycin B, 5-O-demethyl-28-deoxy-6,28-epoxy-13-(2-methyl-1-oxopropoxy)-25-(1-methyl-1-propenyl)-, (6R,13R,25S)-

Basic Attributes
Characteristics
Drug Information
Computed Properties
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