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

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a pentitol

	Properties	Image
MNX_ID	MNXM1132993
reference	metacycM:Pentitols
formula	C₅H₁₂O₅
global charge	0
mol weight	152.146
InChIKey	HEBKCHPVOIAQTA-UHFFFAOYSA-N
InChI	InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2
SMILES	OCC(O)C(O)C(O)CO

MNX internals

InChI (mnx)	InChI=1/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3?,4?,5?
SMILES (mnx)	[CH2:1]([CH:3]([CH:5]([CH:4]([CH2:2][OH:7])[OH:9])[OH:10])[OH:8])[OH:6]

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
Identifier	Description
metacyc.compound:Pentitols metacycM:Pentitols HEBKCHPVOIAQTA-UHFFFAOYSA-N	a pentitol
envipath:...add91bdc0598 envipathM:...add91bdc0598 HEBKCHPVOIAQTA-UHFFFAOYSA-N	compound 0280863