 Home > Encyclopedia > 4-[7-[5-[1,4-dihydroxy-4-[5-(1-hydroxytridecyl)oxolan-2-yl]butyl]oxolan-2-yl]-2-hydroxyheptyl]-2-methyl-2H-furan-5-one

4-[7-[5-[1,4-dihydroxy-4-[5-(1-hydroxytridecyl)oxolan-2-yl]butyl]oxolan-2-yl]-2-hydroxyheptyl]-2-methyl-2H-furan-5-one

4-[7-[5-[1,4-dihydroxy-4-[5-(1-hydroxytridecyl)oxolan-2-yl]butyl]oxolan-2-yl]-2-hydroxyheptyl]-2-methyl-2H-furan-5-one structure

CAS No:
130818-48-3
Formula:
C37H66O8
Chemical Name:
4-[7-[5-[1,4-dihydroxy-4-[5-(1-hydroxytridecyl)oxolan-2-yl]butyl]oxolan-2-yl]-2-hydroxyheptyl]-2-methyl-2H-furan-5-one
Synonyms:
Gigantecin;

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4-[7-[5-[1,4-dihydroxy-4-[5-(1-hydroxytridecyl)oxolan-2-yl]butyl]oxolan-2-yl]-2-hydroxyheptyl]-2-methyl-2H-furan-5-one Basic Attributes

Molecular Weight：

638.91500

Exact Mass：

638.47576906 g/mol

Characteristics

PSA：

125.68000

XLogP3：

6.82870

Density：

1.076g/cm3

Boiling Point：

776.4ºC

Flash Point：

230.6ºC

Refractive Index：

1.511

Vapor Pressure：

7.74E-28mmHg at 25°C

Drug Information

MeSH Entry Terms：

gigantecin

Computed Properties

Molecular Weight:638.9
XLogP3:8.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:25
Exact Mass:638.47576906
Monoisotopic Mass:638.47576906
Topological Polar Surface Area:126
Heavy Atom Count:45
Complexity:833
Undefined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[7-[5-[1,4-dihydroxy-4-[5-(1-hydroxytridecyl)oxolan-2-yl]butyl]oxolan-2-yl]-2-hydroxyheptyl]-2-methyl-2H-furan-5-one

Basic Attributes
Characteristics
Drug Information
Computed Properties

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