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 4 results

Search term: IDGNDQYOCKRQMV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8884406

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C17H28O4/c1-12-6-5-7-13(2)15(18)8-10-17(4,20)11-9-16(19)21-14(12)3/h7,9,11-12,14-15,18,20H,5-6,8,10H2,1-4H3/b11-9+,13-7+/t12-,14+,15-,17+/m0/s1
C17H28O4296.40184400
26596962

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C17H28O4/c1-12-6-5-7-13(2)15(18)8-10-17(4,20)11-9-16(19)21-14(12)3/h7,9,11-12,14-15,18,20H,5-6,8,10H2,1-4H3/b11-9+,13-7+/t12-,14+,15+,17+/m0/s1
C17H28O4296.40181100
74155758

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C17H28O4/c1-12-6-5-7-13(2)15(18)8-10-17(4,20)11-9-16(19)21-14(12)3/h7,9,11-12,14-15,18,20H,5-6,8,10H2,1-4H3/b11-9+,13-7-/t12-,14+,15-,17+/m0/s1
C17H28O4296.40181100
78437365

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C17H28O4/c1-12-6-5-7-13(2)15(18)8-10-17(4,20)11-9-16(19)21-14(12)3/h7,9,11-12,14-15,18,20H,5-6,8,10H2,1-4H3/b11-9+,13-7+/t12-,14+,15?,17+/m0/s1
C17H28O4296.40181100

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