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Homocitrulline

Homocitrulline structure

CAS No:
1190-49-4
Formula:
C7H15N3O3
Chemical Name:
Homocitrulline
Synonyms:
L-Lysine,N6-(aminocarbonyl)-;Lysine,N6-carbamoyl-,L-;Lysine,N6-carbamoyl-;N6-(Aminocarbonyl)-L-lysine;Homocitrulline;L-Homocitrulline;N-ε-Carbamyl-L-lysine;Homo-L-citrulline;NSC 27428;(S)-2-Amino-6-ureidohexanoic acid;16414-75-8
Categories:
Biochemical Engineering > Amino Acids and Proteins

Description

ChEBI: A L-lysine derivative that is L-lysine having a carbamoyl group at the N6-position. It is found in individuals with urea cycle disorders.

Homocitrulline Basic Attributes

Molecular Weight：

189.21

Exact Mass：

189.21

EC Number：

214-722-0

NSC Number：

27428

DSSTox ID：

DTXSID70282694

HScode：

2924199090

Characteristics

PSA：

118

XLogP3：

-3.9

Appearance：

Solid

Density：

1.24

Melting Point：

211-212 °C (decomp)

Boiling Point：

393.0±42.0 °C(Predicted)

Flash Point：

191.5±27.9 °C

Refractive Index：

1.525

Water Solubility：

H2O: soluble (49 g/L) (25 ºC)

Storage Conditions：

2-8°C

Vapor Pressure：

2.86E-07mmHg at 25°C

Safety Information

wgk germany：

hazard class code：

R36/37/38:Irritating to eyes, respiratory system and skin .

safety instructions：

S26-S36/37/39

Marks：

Computed Properties

Molecular Weight:189.21
XLogP3:-3.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:189.11134135
Monoisotopic Mass:189.11134135
Topological Polar Surface Area:118
Heavy Atom Count:13
Complexity:184
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 1190-49-4

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Guide of Homocitrulline

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
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