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: GNTZLKVQQONGDC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
27024345

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O3/c1-8-13(2)18-21(6)12-14(3)17-20(5,10-9-16(23)24)11-15(4)19(25-18)22(17,21)7/h8-12,17-19H,1-7H3,(H,23,24)/b10-9+,13-8-/t17-,18-,19+,20-,21+,22-/m1/s1
C22H30O3342.47184500
58197143

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O3/c1-8-13(2)18-21(6)12-14(3)17-20(5,10-9-16(23)24)11-15(4)19(25-18)22(17,21)7/h8-12,17-19H,1-7H3,(H,23,24)/b10-9+,13-8+/t17-,18+,19+,20-,21+,22-/m1/s1
C22H30O3342.47181100
74175321

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C22H30O3/c1-8-13(2)18-21(6)12-14(3)17-20(5,10-9-16(23)24)11-15(4)19(25-18)22(17,21)7/h8-12,17-19H,1-7H3,(H,23,24)/b10-9+,13-8+/t17-,18+,19?,20-,21+,22-/m1/s1
C22H30O3342.47181200
74175338

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C22H30O3/c1-8-13(2)18-21(6)12-14(3)17-20(5,10-9-16(23)24)11-15(4)19(25-18)22(17,21)7/h8-12,17-19H,1-7H3,(H,23,24)/b10-9+,13-8+/t17-,18-,19?,20-,21+,22-/m1/s1
C22H30O3342.47181100

Advertisement