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8-deazahomofolic acid

8-deazahomofolic acid structure

CAS No:
111113-73-6
Formula:
C21H22N6O6
Chemical Name:
8-deazahomofolic acid
Synonyms:
8-deazahomofolic acid;(4-((2-(2-amino-4-oxo-1,4-dihydropyrido[3,2-d]pyrimidin-6-yl)ethyl)amino)benzoyl)-L-glutamic acid;DTXSID60149505;N-(4-((2-(2-Amino-1,4-dihydro-4-oxopyrido(3,2-d)pyrimidin-6-yl)ethyl)amino)benzoyl)-L-glutamic acid;L-Glutamic acid, N-(4-((2-(2-amino-1,4-dihydro-4-oxopyrido(3,2-d)pyrimidin-6-yl)ethyl)amino)benzoyl)-
Categories:
Dyes and Pigments > Pigment

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8-deazahomofolic acid Basic Attributes

Molecular Weight：

454.43598

Exact Mass：

454.16

DSSTox ID：

DTXSID60149505

Characteristics

PSA：

196

XLogP3：

0.1

Density：

1.57g/cm3

Refractive Index：

1.719

Drug Information

MeSH Entry Terms：

8-deazahomofolic acid

Computed Properties

Molecular Weight:454.4
XLogP3:0.1
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:10
Exact Mass:454.16008244
Monoisotopic Mass:454.16008244
Topological Polar Surface Area:196
Heavy Atom Count:33
Complexity:781
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes