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

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lawsone

	Properties	Image
MNX_ID	MNXM1371375
reference	chebi:44401
formula	C₁₀H₆O₃
global charge	0
mol weight	174.155
InChIKey	CSFWPUWCSPOLJW-UHFFFAOYSA-N
InChI	InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,12H
SMILES	O=C1C=C(O)C(=O)C2=C1C=CC=C2

MNX internals

InChI (mnx)	InChI=1/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,12H
SMILES (mnx)	[CH:1]1=[CH:2][CH:4]=[C:7]2[C:6](=[CH:3]1)[C:8](=[O:11])[CH:5]=[C:9]([OH:12])[C:10]2=[O:13]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:44401 chebi:44401 CSFWPUWCSPOLJW-UHFFFAOYSA-N	lawsone 2-HYDROXYNAPHTHOQUINONE 2-hydroxy-1,4-naphthalenedione 2-hydroxy-1,4-naphthoquinone 2-hydroxynaphthalene-1,4-dione Henna Lawsone
sabiork.compound:25711 sabiorkM:25711 CSFWPUWCSPOLJW-UHFFFAOYSA-N	2-Hydroxy-1,4-naphthoquinone
envipath:...25a5ff6ff057 envipathM:...25a5ff6ff057 envipath:...0e5480296558 envipathM:...0e5480296558 CSFWPUWCSPOLJW-UHFFFAOYSA-N	HN
sabiork.compound:12453 sabiorkM:12453 kegg.compound:C10368 keggC:C10368 CSFWPUWCSPOLJW-UHFFFAOYSA-N	Lawsone
metacyc.compound:CPD-9608 metacycM:CPD-9608 CSFWPUWCSPOLJW-UHFFFAOYSA-M	lawsone 2-hydroxy-1,4-naphthoquinone
chebi:44399 chebi:6395 keggC:M_C10368	secondary/obsolete/fantasy identifier