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hercynylselenocysteine

MNXM145905 is deprecated and replaced by MNXM1100456
PropertiesImage
MNX_IDMNXM1100456 Image of MNXM1100456
referencechebi:79070
formulaC12H20N4O4Se
global charge0
mol weight363.276
InChIKeyWUKYFFAYSLDGLI-IUCAKERBSA-N
InChIInChI=1S/C12H20N4O4Se/c1-16(2,3)9(11(19)20)4-7-5-14-12(15-7)21-6-8(13)10(17)18/h5,8-9H,4,6,13H2,1-3H3,(H2-,14,15,17,18,19,20)/t8-,9-/m0/s1
SMILESC[N+](C)(C)[C@@H](CC1=CNC([Se]C[C@H](N)C(=O)O)=N1)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C12H20N4O4Se/c1-16(2,3)9(11(19)20)4-7-5-14-12(15-7)21-6-8(13)10(17)18/h5,8-9H,4,6,13H2,1-3H3,(H2-,14,15,17,18,19,20)/t8-,9-/m0/s1 Image of MNXM1100456
SMILES (mnx)[CH3:1][N+:16]([CH3:2])([CH3:3])[C@@H:9]([CH2:4][C:7]1=[CH:5][N:14]=[C:12]([Se:21][CH2:6][C@@H:8]([C:10](=[O:17])[OH:18])[NH2:13])[NH:15]1)[C:11](=[O:19])[O-:20]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:79070
chebi:79070
WUKYFFAYSLDGLI-IUCAKERBSA-N 		hercynylselenocysteine
(2S)-3-(2-{[(2R)-2-amino-2-carboxyethyl]selanyl}-1H-imidazol-4-yl)-2-(trimethylazaniumyl)propanoate

metacyc.compound:CPD-17044
metacycM:CPD-17044
seed.compound:cpd31962
seedM:cpd31962
WUKYFFAYSLDGLI-IUCAKERBSA-N 		hercynylselenocysteine

CHEBI:82705
chebi:82705
WUKYFFAYSLDGLI-IUCAKERBSA-N 		hercynylselenocysteine
(2R)-2-azaniumyl-3-({4-[(2S)-2-carboxylato-2-(trimethylazaniumyl)ethyl]-1H-imidazol-2-yl}selanyl)propanoate
hercynylselenocysteine zwitterion

seedM:M_cpd31962 		secondary/obsolete/fantasy identifier