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N-acetylcitrulline

MNXM3314 is deprecated and here replaced by MNXM1369109
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1369109 Image of MNXM1369109
referencechebi:49006
formulaC8H15N3O4
global charge0
mol weight217.225
InChIKeyWMQMIOYQXNRROC-UHFFFAOYSA-N
InChIInChI=1S/C8H15N3O4/c1-5(12)11-6(7(13)14)3-2-4-10-8(9)15/h6H,2-4H2,1H3,(H,11,12)(H,13,14)(H3,9,10,15)
SMILESCC(=O)NC(CCCNC(N)=O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C8H15N3O4/c1-5(12)11-6(7(13)14)3-2-4-10-8(9)15/h6H,2-4H2,1H3,(H,11,12)(H,13,14)(H3,9,10,15)/t6? Image of MNXM1369109
SMILES (mnx)[CH3:1][C:5](=[N:11][CH:6]([CH2:3][CH2:2][CH2:4][NH:10][C:8](=[NH:9])[OH:15])[C:7](=[O:13])[OH:14])[OH:12]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:49006
chebi:49006
WMQMIOYQXNRROC-UHFFFAOYSA-N 		N-acetylcitrulline
2-(acetylamino)-5-[(aminocarbonyl)amino]pentanoic acid
2-acetamido-5-(carbamoylamino)pentanoic acid
N(2)-acetyl-N(5)-carbamoylornithine