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

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(3S,4R)-3,4-dihydrophenanthrene-3,4-diol

	Properties	Image
MNX_ID	MNXM2749
reference	chebi:15386
formula	C₁₄H₁₂O₂
global charge	0
mol weight	212.248
InChIKey	FOTICWSJABVKPW-JSGCOSHPSA-N
InChI	InChI=1S/C14H12O2/c15-12-8-7-10-6-5-9-3-1-2-4-11(9)13(10)14(12)16/h1-8,12,14-16H/t12-,14-/m0/s1
SMILES	O[C@@H]1C2=C3C=CC=CC3=CC=C2C=C[C@@H]1O

MNX internals

InChI (mnx)	InChI=1/C14H12O2/c15-12-8-7-10-6-5-9-3-1-2-4-11(9)13(10)14(12)16/h1-8,12,14-16H/t12-,14-/m0/s1
SMILES (mnx)	[CH:1]1=[CH:2][CH:4]=[C:11]2[C:9](=[CH:3]1)[CH:5]=[CH:6][C:10]1=[C:13]2[C@@H:14]([OH:16])[C@@H:12]([OH:15])[CH:8]=[CH:7]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:15386 chebi:15386 FOTICWSJABVKPW-JSGCOSHPSA-N	(3S,4R)-3,4-dihydrophenanthrene-3,4-diol (+)-cis-3,4-Dihydrophenanthrene-3,4-diol (+)-cis-3,4-dihydrophenanthrene-3,4-diol cis-3,4-Dihydroxy-3,4-dihydrophenanthrene
seed.compound:cpd02726 seedM:cpd02726 FOTICWSJABVKPW-JSGCOSHPSA-N	(+)-cis-3,4-Dihydrophenanthrene-3,4-diol (+)-cis-3,4-dihydrophenanthrene-3,4-diol cis-3,4-Dihydroxy-3,4-dihydrophenanthrene
kegg.compound:C04468 keggC:C04468 FOTICWSJABVKPW-JSGCOSHPSA-N	(+)-cis-3,4-Dihydrophenanthrene-3,4-diol cis-3,4-Dihydroxy-3,4-dihydrophenanthrene
metacyc.compound:CPD-13486 metacycM:CPD-13486 FOTICWSJABVKPW-JSGCOSHPSA-N	(+)-cis-3,4-dihydrophenanthrene-3,4-diol cis-3,4-Dihydroxy-3,4-dihydrophenanthrene
envipath:...e5c52de2fde1 envipathM:...e5c52de2fde1 FOTICWSJABVKPW-JSGCOSHPSA-N	cis-3,4-Dihydroxy-3,4-dihydrophenanthrene
chebi:10751 chebi:54 keggC:M_C04468 seedM:M_cpd02726	secondary/obsolete/fantasy identifier