Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 7 results

Search term: UJJKWQRTTYLTQL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
11322491

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H28O2/c1-6-7-8-16(13(2)3)10-9-14(4)11-12-18-15(5)17/h6,14,16H,1-2,7-12H2,3-5H3
C16H28O2252.3923111200
23352169

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H28O2/c1-6-7-8-16(13(2)3)10-9-14(4)11-12-18-15(5)17/h6,14,16H,1-2,7-12H2,3-5H3/t14-,16+/m0/s1
C16H28O2252.39236800
32700520

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H28O2/c1-6-7-8-16(13(2)3)10-9-14(4)11-12-18-15(5)17/h6,14,16H,1-2,7-12H2,3-5H3/t14-,16-/m0/s1
C16H28O2252.39234600
9087279

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C16H28O2/c1-6-7-8-16(13(2)3)10-9-14(4)11-12-18-15(5)17/h6,14,16H,1-2,7-12H2,3-5H3/t14?,16-/m1/s1
C16H28O2252.39232100
9109238

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C16H28O2/c1-6-7-8-16(13(2)3)10-9-14(4)11-12-18-15(5)17/h6,14,16H,1-2,7-12H2,3-5H3/t14-,16?/m0/s1
C16H28O2252.39232100
95602116

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H28O2/c1-6-7-8-16(13(2)3)10-9-14(4)11-12-18-15(5)17/h6,14,16H,1-2,7-12H2,3-5H3/t14-,16-/m1/s1
C16H28O2252.39231200
95602117

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H28O2/c1-6-7-8-16(13(2)3)10-9-14(4)11-12-18-15(5)17/h6,14,16H,1-2,7-12H2,3-5H3/t14-,16+/m1/s1
C16H28O2252.39231100

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