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

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18-crown-6

	Properties	Image
MNX_ID	MNXM33751
reference	chebi:32397
formula	C₁₂H₂₄O₆
global charge	0
mol weight	264.318
InChIKey	XEZNGIUYQVAUSS-UHFFFAOYSA-N
InChI	InChI=1S/C12H24O6/c1-2-14-5-6-16-9-10-18-12-11-17-8-7-15-4-3-13-1/h1-12H2
SMILES	C1COCCOCCOCCOCCOCCO1

MNX internals

InChI (mnx)	InChI=1/C12H24O6/c1-2-14-5-6-16-9-10-18-12-11-17-8-7-15-4-3-13-1/h1-12H2
SMILES (mnx)	[CH2:1]1[CH2:2][O:14][CH2:5][CH2:6][O:16][CH2:9][CH2:10][O:18][CH2:12][CH2:11][O:17][CH2:8][CH2:7][O:15][CH2:4][CH2:3][O:13]1

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
Identifier	Description
CHEBI:32397 chebi:32397 XEZNGIUYQVAUSS-UHFFFAOYSA-N	18-crown-6 1,4,7,10,13,16-hexaoxacyclooctadecane 18-crown-6 ether ethylene oxide cyclic hexamer
hmdb:HMDB0244804 XEZNGIUYQVAUSS-UHFFFAOYSA-N	1,4,7,10,13,16-Hexaoxacyclooctadecane 1,4,7,10,13,16-hexaoxacyclooctadecane 18-Crown-6 ether 18-crown-6 ether Ethylene oxide cyclic hexamer
seed.compound:cpd30637 seedM:cpd30637	18-Crown-6
seedM:M_cpd30637	secondary/obsolete/fantasy identifier