MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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L-histidinol

	Properties	Image
MNX_ID	MNXM1281
reference	chebi:57699
formula	C₆H₁₂N₃O
global charge	1
mol weight	142.182
InChIKey	ZQISRDCJNBUVMM-YFKPBYRVSA-O
InChI	InChI=1S/C6H11N3O/c7-5(3-10)1-6-2-8-4-9-6/h2,4-5,10H,1,3,7H2,(H,8,9)/p+1/t5-/m0/s1
SMILES	[NH3+][C@H](CO)CC1=CNC=N1

MNX internals

InChI (mnx)	InChI=1/C6H11N3O/c7-5(3-10)1-6-2-8-4-9-6/h2,4-5,10H,1,3,7H2,(H,8,9)/t5-/m0/s1
SMILES (mnx)	[CH2:1]([C@@H:5]([CH2:3][OH:10])[NH2:7])[C:6]1=[CH:2][N:8]=[CH:4][NH:9]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	7

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57699 chebi:57699 ZQISRDCJNBUVMM-YFKPBYRVSA-O	L-histidinol (2S)-1-hydroxy-3-(1H-imidazol-4-yl)propan-2-aminium L-histidinol cation L-histidinol(1+)
hmdb:HMDB0253185 ZQISRDCJNBUVMM-UHFFFAOYSA-N	Histidinol 2-amino-3-(1H-imidazol-5-yl)propan-1-ol 2-amino-3-(3H-imidazol-4-yl)propan-1-ol Histidol
bigg.metabolite:histd biggM:histd sabiork.compound:5283 sabiorkM:5283 kegg.compound:C00860 keggC:C00860 ZQISRDCJNBUVMM-UHFFFAOYSA-O ZQISRDCJNBUVMM-YFKPBYRVSA-N	L-Histidinol
hmdb:HMDB0003431 ZQISRDCJNBUVMM-YFKPBYRVSA-N	L-Histidinol (2S)-2-Amino-3-(1H-imidazol-4-yl)propan-1-ol (2S)-2-amino-3-(1H-imidazol-5-yl)propan-1-ol (S)-Histidinol (S)-beta-amino-1H-Imidazole-4-propanol (betaS)-beta-Amino-1H-imidazole-5-propanol 4-[(S)-2-Amino-3-hydroxypropyl]imidazole HSO Histidinol Histidol Imidazole C-4(5) deriv. 4 beta-Amino-1H-imidazole-5-propanol
vmhM:histd vmhmetabolite:histd ZQISRDCJNBUVMM-YFKPBYRVSA-O	L-Histidinol (2S)-2-amino-3-(1H-imidazol-5-yl)propan-1-ol
seed.compound:cpd00641 seedM:cpd00641 ZQISRDCJNBUVMM-YFKPBYRVSA-O	L-Histidinol L-histidinol histd histidinol histidol
CHEBI:16255 chebi:16255 ZQISRDCJNBUVMM-YFKPBYRVSA-N	L-histidinol (2S)-2-amino-3-(1H-imidazol-4-yl)propan-1-ol 4-[(S)-2-amino-3-hydroxypropyl]imidazole L-Histidinol
metacyc.compound:HISTIDINOL metacycM:HISTIDINOL ZQISRDCJNBUVMM-YFKPBYRVSA-O	histidinol L-histidinol histidol
hmdb:HMDB03431 chebi:13118 chebi:21326 chebi:6241 biggM:M_histd keggC:M_C00860 seedM:M_cpd00641 vmhM:M_histd	secondary/obsolete/fantasy identifier