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
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Found 294 results

Search term: C55H96O6 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
30777730

Double-bond stereo
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-26-27-28-31-34-37-40-43-46-49-55(58)61-52(50-59-53(56)47-44-41-38-35-32-29-23-20-17-14-11-8-5-2)51-60-54(57)48-45-42-39-36-33-30-24-21-18-15-12-9-6-3/h7,10,16,19,25-26,28,31,37,40,52H,4-6,8-9,11-15,17-18,20-24,27,29-30,32-36,38-39,41-51H2,1-3H3/b10-7-,19-16-,26-25-,31-28-,40-37-
C55H96O6853.3471141400
7823078

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-29-24-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h16-17,19-21,24-28,52H,4-15,18,22-23,29-51H2,1-3H3/b19-16-,20-17-,24-21-,27-25-,28-26-/t52-/m1/s1
C55H96O6853.34719900
7823100

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-26-27-28-31-33-36-39-42-45-48-54(57)60-51-52(61-55(58)49-46-43-40-37-34-30-24-21-18-15-12-9-6-3)50-59-53(56)47-44-41-38-35-32-29-23-20-17-14-11-8-5-2/h16,19,21,24-26,28,31,36,39,52H,4-15,17-18,20,22-23,27,29-30,32-35,37-38,40-51H2,1-3H3/b19-16-,24-21-,26-25-,31-28-,39-36-/t52-/m1/s1
C55H96O6853.34719900
59655412

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-24-26-27-29-30-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-31-28-25-23-20-17-14-11-8-5-2/h8,11,15,17-18,20,25,28,34,37,52H,4-7,9-10,12-14,16,19,21-24,26-27,29-33,35-36,38-51H2,1-3H3/b11-8-,18-15-,20-17-,28-25-,37-34-/t52-/m1/s1
C55H96O6853.34716700
59673916

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-24-26-27-29-31-34-36-39-42-45-48-54(57)60-51-52(61-55(58)49-46-43-40-37-32-21-18-15-12-9-6-3)50-59-53(56)47-44-41-38-35-33-30-28-25-23-20-17-14-11-8-5-2/h16,19,24-26,28-29,31,36,39,52H,4-15,17-18,20-23,27,30,32-35,37-38,40-51H2,1-3H3/b19-16-,26-24-,28-25-,31-29-,39-36-/t52-/m0/s1
C55H96O6853.34715600
59673934

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-27-30-32-35-38-41-44-47-53(56)59-50-52(61-55(58)49-46-43-40-37-34-29-24-21-18-15-12-9-6-3)51-60-54(57)48-45-42-39-36-33-31-28-26-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,25-28,52H,4-6,8-9,11-15,18,21-24,29-51H2,1-3H3/b10-7-,19-16-,20-17-,27-25-,28-26-/t52-/m1/s1
C55H96O6853.34715600
30777885

Double-bond stereo
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-26-27-28-31-34-37-40-43-46-49-55(58)61-52(50-59-53(56)47-44-41-38-35-32-29-23-20-17-14-11-8-5-2)51-60-54(57)48-45-42-39-36-33-30-24-21-18-15-12-9-6-3/h20-21,23-26,28,31,37,40,52H,4-19,22,27,29-30,32-36,38-39,41-51H2,1-3H3/b23-20-,24-21-,26-25-,31-28-,40-37-
C55H96O6853.34715500
30777895

Double-bond stereo
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-26-27-28-31-34-37-40-43-46-49-55(58)61-52(50-59-53(56)47-44-41-38-35-32-29-23-20-17-14-11-8-5-2)51-60-54(57)48-45-42-39-36-33-30-24-21-18-15-12-9-6-3/h16,19-21,23-26,28,31,52H,4-15,17-18,22,27,29-30,32-51H2,1-3H3/b19-16-,23-20-,24-21-,26-25-,31-28-
C55H96O6853.34715500
59651518

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-26-27-28-31-33-36-39-42-45-48-54(57)60-51-52(61-55(58)49-46-43-40-37-34-30-24-21-18-15-12-9-6-3)50-59-53(56)47-44-41-38-35-32-29-23-20-17-14-11-8-5-2/h16,19,21,24-26,28,31,36,39,52H,4-15,17-18,20,22-23,27,29-30,32-35,37-38,40-51H2,1-3H3/b19-16-,24-21-,26-25-,31-28-,39-36-/t52-/m0/s1
C55H96O6853.34715600
59651577

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-29-24-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h16-17,19-21,24-28,52H,4-15,18,22-23,29-51H2,1-3H3/b19-16-,20-17-,24-21-,27-25-,28-26-/t52-/m0/s1
C55H96O6853.34715600
24768224

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-24-26-27-29-31-34-36-39-42-45-48-54(57)60-51-52(61-55(58)49-46-43-40-37-32-21-18-15-12-9-6-3)50-59-53(56)47-44-41-38-35-33-30-28-25-23-20-17-14-11-8-5-2/h16,19,24-26,28-29,31,36,39,52H,4-15,17-18,20-23,27,30,32-35,37-38,40-51H2,1-3H3/b19-16-,26-24-,28-25-,31-29-,39-36-/t52-/m1/s1
C55H96O6853.34715400
24768239

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-27-30-32-35-38-41-44-47-53(56)59-50-52(61-55(58)49-46-43-40-37-34-29-24-21-18-15-12-9-6-3)51-60-54(57)48-45-42-39-36-33-31-28-26-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,25-28,52H,4-6,8-9,11-15,18,21-24,29-51H2,1-3H3/b10-7-,19-16-,20-17-,27-25-,28-26-/t52-/m0/s1
C55H96O6853.34715400
30777703

Double-bond stereo
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-31-34-37-40-43-46-49-55(58)61-52(50-59-53(56)47-44-41-38-35-32-23-20-17-14-11-8-5-2)51-60-54(57)48-45-42-39-36-33-24-21-18-15-12-9-6-3/h16,19,25-26,28-29,31,34,40,43,52H,4-15,17-18,20-24,27,30,32-33,35-39,41-42,44-51H2,1-3H3/b19-16-,26-25-,29-28-,34-31-,43-40-
C55H96O6853.34715500
30777708

Double-bond stereo
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-31-34-37-40-43-46-49-55(58)61-52(50-59-53(56)47-44-41-38-35-32-23-20-17-14-11-8-5-2)51-60-54(57)48-45-42-39-36-33-24-21-18-15-12-9-6-3/h7,10,16,19,25-26,28-29,31,34,52H,4-6,8-9,11-15,17-18,20-24,27,30,32-33,35-51H2,1-3H3/b10-7-,19-16-,26-25-,29-28-,34-31-
C55H96O6853.34715500
7823101

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-26-27-28-31-33-36-39-42-45-48-54(57)60-51-52(61-55(58)49-46-43-40-37-34-30-24-21-18-15-12-9-6-3)50-59-53(56)47-44-41-38-35-32-29-23-20-17-14-11-8-5-2/h7,10,16,19,25-26,28,31,36,39,52H,4-6,8-9,11-15,17-18,20-24,27,29-30,32-35,37-38,40-51H2,1-3H3/b10-7-,19-16-,26-25-,31-28-,39-36-/t52-/m1/s1
C55H96O6853.34714500
24764381
InChI=1/C55H96O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-47-60-54(58)52(49-50-43-45-51(46-44-50)53(56)57)55(59)61-48-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h43-46,49H,3-42,47-48H2,1-2H3,(H,56,57)
C55H96O6853.34714300
7823083

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-29-24-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h7,10,16,19,21,24-28,52H,4-6,8-9,11-15,17-18,20,22-23,29-51H2,1-3H3/b10-7-,19-16-,24-21-,27-25-,28-26-/t52-/m1/s1
C55H96O6853.34714500
7823099

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-25-26-27-28-31-33-36-39-42-45-48-54(57)60-51-52(61-55(58)49-46-43-40-37-34-30-24-21-18-15-12-9-6-3)50-59-53(56)47-44-41-38-35-32-29-23-20-17-14-11-8-5-2/h16,19-21,23-26,28,31,52H,4-15,17-18,22,27,29-30,32-51H2,1-3H3/b19-16-,23-20-,24-21-,26-25-,31-28-/t52-/m1/s1
C55H96O6853.34714500
59660373

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-24-26-27-29-31-34-36-39-42-45-48-54(57)60-51-52(61-55(58)49-46-43-40-37-32-21-18-15-12-9-6-3)50-59-53(56)47-44-41-38-35-33-30-28-25-23-20-17-14-11-8-5-2/h15,17-18,20,24-26,28,33,35,52H,4-14,16,19,21-23,27,29-32,34,36-51H2,1-3H3/b18-15-,20-17-,26-24-,28-25-,35-33-/t52-/m1/s1
C55H96O6853.34714500
59660380

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C55H96O6/c1-4-7-10-13-16-19-22-24-26-27-29-31-34-36-39-42-45-48-54(57)60-51-52(61-55(58)49-46-43-40-37-32-21-18-15-12-9-6-3)50-59-53(56)47-44-41-38-35-33-30-28-25-23-20-17-14-11-8-5-2/h8,11,15,17-18,20,24-26,28,52H,4-7,9-10,12-14,16,19,21-23,27,29-51H2,1-3H3/b11-8-,18-15-,20-17-,26-24-,28-25-/t52-/m1/s1
C55H96O6853.34714500
12345

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