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L-Citrulline

CAT: 0024-sc-204784ASize: 200 gDry Ice: NoHazardous: No
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CAT#:0024-sc-204784ASize:200 g
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CAS Number
372-75-8

Chemical Information

Citrulline

L-citrulline is the L-enantiomer of citrulline. It has a role as a micronutrient, a protective agent, a nutraceutical, an EC 1.14.13.39 (nitric oxide synthase) inhibitor, a mouse metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite and a human metabolite. It is an enantiomer of a D-citrulline. It is a tautomer of a L-citrulline zwitterion.

CAS Number372-75-8
PubChem CID9750
IUPAC Name(2S)-2-amino-5-(carbamoylamino)pentanoic acid
Molecular FormulaC6H13N3O3
Molecular Weight175.19
XLogP-4.3
Topological Polar Surface Area118
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count12
Formal Charge0
Complexity171
SMILES
C(C[C@@H](C(=O)O)N)CNC(=O)N
InChI
InChI=1S/C6H13N3O3/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)/t4-/m0/s1
InChIKey
RHGKLRLOHDJJDR-BYPYZUCNSA-N
Chemical Structure
2D Structure
2D structure of Citrulline
CAS: 372-75-8
CID: 9750
Formula: C6H13N3O3
MW: 175.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight175.19
XLogP3-4.3
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass175.09569129
Monoisotopic Mass175.09569129
Topological Polar Surface Area118 Ų
Heavy Atom Count12
Formal Charge0
Complexity171
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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