L-ornithinium(2+) (CHEBI:44667)

ChEBI > Main

CHEBI:44667 - L-ornithinium(2+)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	L-ornithinium(2+)

ChEBI ID	CHEBI:44667

ChEBI ASCII Name	L-ornithinium(2+)

Definition	The L-enantiomer of ornithinium(2+).

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information	ChemicalBook:CB3888326, ChemicalBook:CB2199856, eMolecules:884260, ZINC000001532530

Download	Molfile XML SDF

more structures >>

call loadScript javascripts\jsmol\core\package.js

call loadScript javascripts\jsmol\core\core.z.js -- required by ClazzNode

call loadScript javascripts\jsmol\J\awtjs2d\WebOutputChannel.js

Jmol JavaScript applet jmolApplet0_object__0175373559380847__ initializing

getValue debug = null

getValue logLevel = null

getValue allowjavascript = null

AppletRegistry.checkIn(jmolApplet0_object__0175373559380847__)

call loadScript javascripts\jsmol\core\corestate.z.js

viewerOptions:

{ "name":"jmolApplet0_object","applet":true,"documentBase":"https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:44667","platform":"J.awtjs2d.Platform","fullName":"jmolApplet0_object__0175373559380847__","display":"jmolApplet0_canvas2d","signedApplet":"true","appletReadyCallback":"Jmol._readyCallback","statusListener":"[J.appletjs.Jmol.MyStatusListener object]","codeBase":"https://www.ebi.ac.uk/chebi/javascripts/jsmol/","syncId":"0175373559380847","bgcolor":"#000" }

Jmol Version: 13.2.7 $Date: 2013-10-01 11:35:15 -0500 (Tue, 01 Oct 2013) $

java.vendor: j2s

java.version: 0.0

os.name: j2s

Access: ALL

memory: 0.0/0.0

processors available: 1

useCommandThread: false

appletId:jmolApplet0_object (signed)

starting HoverWatcher_1

getValue emulate = null

defaults = "Jmol"

getValue boxbgcolor = null

getValue bgcolor = #000

backgroundColor = "#000"

getValue ANIMFRAMECallback = null

getValue APPLETREADYCallback = Jmol._readyCallback

APPLETREADYCallback = "Jmol._readyCallback"

getValue ATOMMOVEDCallback = null

getValue CLICKCallback = null

getValue ECHOCallback = null

getValue ERRORCallback = null

getValue EVALCallback = null

getValue HOVERCallback = null

getValue LOADSTRUCTCallback = null

getValue MEASURECallback = null

getValue MESSAGECallback = null

getValue MINIMIZATIONCallback = null

getValue PICKCallback = null

getValue RESIZECallback = null

getValue SCRIPTCallback = null

getValue SYNCCallback = null

getValue STRUCTUREMODIFIEDCallback = null

getValue doTranslate = null

language=en_US

getValue popupMenu = null

getValue script = null

Jmol applet jmolApplet0_object__0175373559380847__ ready

call loadScript javascripts\jsmol\core\corescript.z.js

call loadScript javascripts\jsmol\J\script\FileLoadThread.js

starting QueueThread0_2

script 1 started

starting HoverWatcher_3

starting HoverWatcher_4

The Resolver thinks Mol

Marvin 10180716223D

starting HoverWatcher_5

Time for openFile(

Marvin 10180716223D

23 22 0 0 0 0 999 V2000

0.5791 1.8486 0.1226 N 0 3 0 0 0 0 0 0 0 0 0 0

0.4199 0.5215 0.7329 C 0 0 1 0 0 0 0 0 0 0 0 0

-0.1326 -0.4546 -0.3075 C 0 0 0 0 0 0 0 0 0 0 0 0

-1.5444 -0.0230 -0.7122 C 0 0 0 0 0 0 0 0 0 0 0 0

-2.0970 -0.9992 -1.7525 C 0 0 0 0 0 0 0 0 0 0 0 0

-3.4519 -0.5849 -2.1408 N 0 3 0 0 0 0 0 0 0 0 0 0

1.7583 0.0289 1.2218 C 0 0 0 0 0 0 0 0 0 0 0 0

2.7758 0.5074 0.7800 O 0 0 0 0 0 0 0 0 0 0 0 0

1.8189 -0.9404 2.1484 O 0 0 0 0 0 0 0 0 0 0 0 0

-0.2717 0.5873 1.5728 H 0 0 0 0 0 0 0 0 0 0 0 0

2.6777 -1.2554 2.4621 H 0 0 0 0 0 0 0 0 0 0 0 0

0.9435 2.4922 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0

1.2189 1.7868 -0.6539 H 0 0 0 0 0 0 0 0 0 0 0 0

-0.3168 2.1780 -0.2041 H 0 0 0 0 0 0 0 0 0 0 0 0

-0.1679 -1.4580 0.1181 H 0 0 0 0 0 0 0 0 0 0 0 0

0.5128 -0.4547 -1.1857 H 0 0 0 0 0 0 0 0 0 0 0 0

-1.5092 0.9794 -1.1374 H 0 0 0 0 0 0 0 0 0 0 0 0

-2.1899 -0.0240 0.1664 H 0 0 0 0 0 0 0 0 0 0 0 0

-2.1323 -2.0026 -1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0

-1.4516 -0.9992 -2.6308 H 0 0 0 0 0 0 0 0 0 0 0 0

-3.8165 -1.2295 -2.8269 H 0 0 0 0 0 0 0 0 0 0 0 0

-3.4200 0.3434 -2.5346 H 0 0 0 0 0 0 0 0 0 0 0 0

-4.0499 -0.5859 -1.3274 H 0 0 0 0 0 0 0 0 0 0 0 0

1 2 1 0 0 0 0

1 12 1 0 0 0 0

1 13 1 0 0 0 0

1 14 1 0 0 0 0

2 3 1 0 0 0 0

2 7 1 0 0 0 0

2 10 1 0 0 0 0

3 4 1 0 0 0 0

3 15 1 0 0 0 0

3 16 1 0 0 0 0

4 5 1 0 0 0 0

4 17 1 0 0 0 0

4 18 1 0 0 0 0

5 6 1 0 0 0 0

5 19 1 0 0 0 0

5 20 1 0 0 0 0

6 21 1 0 0 0 0

6 22 1 0 0 0 0

6 23 1 0 0 0 0

7 8 2 0 0 0 0

7 9 1 0 0 0 0

9 11 1 0 0 0 0

M CHG 2 1 1 6 1

M END): 25 ms

reading 23 atoms

ModelSet: haveSymmetry:false haveUnitcells:false haveFractionalCoord:false

1 model in this collection. Use getProperty "modelInfo" or getProperty "auxiliaryInfo" to inspect them.

Default Van der Waals type for model set to Babel

23 atoms created

ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation

Script completed

Jmol script terminated

Molfile expand

Formula

C5H14N2O2

Net Charge

Average Mass

134.17694

Monoisotopic Mass

134.10443

InChI

InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/p+2/t4-/m0/s1

InChIKey

AHLPHDHHMVZTML-BYPYZUCNSA-P

SMILES

[NH3+]CCC[C@H]([NH3+])C(O)=O

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	See: PubMed

Roles Classification
Biological Role(s):	human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).

View more via ChEBI Ontology

ChEBI Ontology
Outgoing	L-ornithinium(2+) (CHEBI:44667) has role human metabolite (CHEBI:77746) L-ornithinium(2+) (CHEBI:44667) is a ornithinium(2+) (CHEBI:46913) L-ornithinium(2+) (CHEBI:44667) is conjugate acid of L-ornithinium(1+) (CHEBI:46911)

Incoming	L-ornithinium(1+) (CHEBI:46911) is conjugate base of L-ornithinium(2+) (CHEBI:44667)

IUPAC Names

(1S)-1-carboxybutane-1,4-diaminium

L-ornithinediium

Synonyms	Sources
L-ornithine dication	JCBN
L-ornithinium(2+)	JCBN
ORNITHINE	PDBeChem

Manual Xref	Database
ORN_LFOH	PDBeChem
View more database links

Registry Number	Type	Source
1068689	Gmelin Registry Number	Gmelin

Citation	Type	Source
12297216	PubMed citation	Europe PMC

Last Modified

11 November 2014

CHEBI:44667 - L-ornithinium(2+)

ChEBI is part of the ELIXIR infrastructure