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Guanidylfungin B

Guanidylfungin B structure

CAS No:
94116-20-8
Formula:
C57H101N3O18
Chemical Name:
Guanidylfungin B
Synonyms:
Guanidylfungin A,N-demethyl-,(9alpha,11alpha,13E,15S); Guanidylfungin B;
Categories:
Organic Chemistry > Lactones

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Guanidylfungin B Basic Attributes

Molecular Weight：

1116.42000

Exact Mass：

1115.70801338

Characteristics

PSA：

383.56000

XLogP3：

4.42170

Density：

1.29g/cm3

Boiling Point：

1193ºC at 760mmHg

Flash Point：

675.3ºC

Refractive Index：

1.569

Drug Information

MeSH Entry Terms：

guanidylfungin B

Computed Properties

Molecular Weight:1116.4
XLogP3:3.7
Hydrogen Bond Donor Count:14
Hydrogen Bond Acceptor Count:19
Rotatable Bond Count:13
Exact Mass:1115.70801338
Monoisotopic Mass:1115.70801338
Topological Polar Surface Area:386
Heavy Atom Count:78
Complexity:1920
Undefined Atom Stereocenter Count:21
Defined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes