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

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biphenyl-2,2',3-triol

	Properties	Image
MNX_ID	MNXM3552
reference	chebi:28517
formula	C₁₂H₁₀O₃
global charge	0
mol weight	202.209
InChIKey	USBNIYMZDQVDSO-UHFFFAOYSA-N
InChI	InChI=1S/C12H10O3/c13-10-6-2-1-4-8(10)9-5-3-7-11(14)12(9)15/h1-7,13-15H
SMILES	OC1=CC=CC=C1C1=CC=CC(O)=C1O

MNX internals

InChI (mnx)	InChI=1/C12H10O3/c13-10-6-2-1-4-8(10)9-5-3-7-11(14)12(9)15/h1-7,13-15H
SMILES (mnx)	[CH:1]1=[CH:2][CH:6]=[C:10]([OH:13])[C:8]([C:9]2=[C:12]([OH:15])[C:11]([OH:14])=[CH:7][CH:3]=[CH:5]2)=[CH:4]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:28517 chebi:28517 USBNIYMZDQVDSO-UHFFFAOYSA-N	biphenyl-2,2',3-triol 2,2',3-Trihydroxybiphenyl 2,2',3-biphenyltriol 3-(2-hydroxyphenyl)catechol [1,1'-biphenyl]-2,2',3-triol
kegg.compound:C03569 keggC:C03569 USBNIYMZDQVDSO-UHFFFAOYSA-N	2,2',3-Trihydroxybiphenyl
seed.compound:cpd02240 seedM:cpd02240 USBNIYMZDQVDSO-UHFFFAOYSA-N	2,2',3-Trihydroxybiphenyl 2,2',3-biphenyltriol 2,2',3-trihydroxybiphenyl 3-(2-hydroxyphenyl)catechol biphenyl-2,2',3-triol
metacyc.compound:CPD-927 metacycM:CPD-927 USBNIYMZDQVDSO-UHFFFAOYSA-N	2,2',3-trihydroxybiphenyl 2,2',3-biphenyltriol 3-(2-hydroxyphenyl)catechol biphenyl-2,2',3-triol
vmhM:thxbiphe vmhmetabolite:thxbiphe USBNIYMZDQVDSO-UHFFFAOYSA-N	2,2,3-Trihydroxybiphenyl
envipath:...ee2334c0673a envipathM:...ee2334c0673a USBNIYMZDQVDSO-UHFFFAOYSA-N	2,2`,3-Trihydroxybiphenyl
envipath:...ea3dbd4ab1e7 envipathM:...ea3dbd4ab1e7 USBNIYMZDQVDSO-UHFFFAOYSA-N	compound 0043859
chebi:19276 chebi:852 keggC:M_C03569 seedM:M_cpd02240 vmhM:M_thxbiphe	secondary/obsolete/fantasy identifier