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 5 results

Search term: WMJBMNBISBTQLR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4270511

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C21H30O6/c1-14(2)18-10-5-15(3)11-19(18)27-21(23)13-26-20(22)12-25-17-8-6-16(24-4)7-9-17/h6-9,14-15,18-19H,5,10-13H2,1-4H3
C21H30O6378.45939400
6001526

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H30O6/c1-14(2)18-10-5-15(3)11-19(18)27-21(23)13-26-20(22)12-25-17-8-6-16(24-4)7-9-17/h6-9,14-15,18-19H,5,10-13H2,1-4H3/t15-,18-,19-/m1/s1
C21H30O6378.45932100
6001528

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H30O6/c1-14(2)18-10-5-15(3)11-19(18)27-21(23)13-26-20(22)12-25-17-8-6-16(24-4)7-9-17/h6-9,14-15,18-19H,5,10-13H2,1-4H3/t15-,18+,19+/m0/s1
C21H30O6378.45932100
6001529

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H30O6/c1-14(2)18-10-5-15(3)11-19(18)27-21(23)13-26-20(22)12-25-17-8-6-16(24-4)7-9-17/h6-9,14-15,18-19H,5,10-13H2,1-4H3/t15-,18+,19-/m1/s1
C21H30O6378.45932100
6001530

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H30O6/c1-14(2)18-10-5-15(3)11-19(18)27-21(23)13-26-20(22)12-25-17-8-6-16(24-4)7-9-17/h6-9,14-15,18-19H,5,10-13H2,1-4H3/t15-,18-,19+/m0/s1
C21H30O6378.45932100

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