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 11 results

Search term: C47H78NO9P (Found by molecular formula)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24608500

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C47H78NO9P/c1-4-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-39-47(51)57-44(41-55-58(52,53)56-42-45(48)43(3)49)40-54-46(50)38-36-34-32-30-28-26-24-19-17-15-13-11-9-7-5-2/h6,8,12,14,18,20,22-23,27,29,32-35,44-45H,4-5,7,9-11,13,15-17,19,21,24-26,28,30-31,36-42,48H2,1-3H3,(H,52,53)/b8-6-,14-12-,20-18-,23-22-,29-27-,34-32-,35-33-
C47H78NO9P832.09731100
117218317

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C47H78NO9P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-46(50)54-42-45(43-56-58(52,53)55-41-40-48)57-47(51)39-38-44(49)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,24,26,30,32,34,36,44-45,49H,3-5,7,9-10,15-16,21-23,25,27-29,31,33,35,37-43,48H2,1-2H3,(H,52,53)/b8-6-,13-11-,14-12-,19-17-,20-18-,26-24-,32-30-,36-34-/t44?,45-/m1/s1
C47H78NO9P832.09731100
117218318

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C47H78NO9P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-47(51)57-45(43-56-58(52,53)55-41-40-48)42-54-46(50)39-38-44(49)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,24,26,30,32,34,36,44-45,49H,3-5,7,9-10,15-16,21-23,25,27-29,31,33,35,37-43,48H2,1-2H3,(H,52,53)/b8-6-,13-11-,14-12-,19-17-,20-18-,26-24-,32-30-,36-34-/t44?,45-/m1/s1
C47H78NO9P832.09731100
117218319

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C47H78NO9P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-34-38-46(50)54-42-45(43-56-58(52,53)55-41-40-48)57-47(51)39-35-31-33-37-44(49)36-32-29-27-25-23-21-16-14-12-10-8-6-4-2/h6,8,11-14,17-18,21,23,27,29,31-33,36,44-45,49H,3-5,7,9-10,15-16,19-20,22,24-26,28,30,34-35,37-43,48H2,1-2H3,(H,52,53)/b8-6-,13-11-,14-12-,18-17-,23-21-,29-27-,33-31-,36-32-/t44?,45-/m1/s1
C47H78NO9P832.09731100
117218320

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C47H78NO9P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-34-39-47(51)57-45(43-56-58(52,53)55-41-40-48)42-54-46(50)38-35-31-33-37-44(49)36-32-29-27-25-23-21-16-14-12-10-8-6-4-2/h6,8,11-14,17-18,21,23,27,29,31-33,36,44-45,49H,3-5,7,9-10,15-16,19-20,22,24-26,28,30,34-35,37-43,48H2,1-2H3,(H,52,53)/b8-6-,13-11-,14-12-,18-17-,23-21-,29-27-,33-31-,36-32-/t44?,45-/m1/s1
C47H78NO9P832.09731100
117218321

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C47H78NO9P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-23-26-30-34-38-46(50)54-42-45(43-56-58(52,53)55-41-40-48)57-47(51)39-35-31-27-24-21-20-22-25-29-33-37-44(49)36-32-28-10-8-6-4-2/h6,8,11-12,14-15,20-21,25,27-29,31-33,37,44-45,49H,3-5,7,9-10,13,16-19,22-24,26,30,34-36,38-43,48H2,1-2H3,(H,52,53)/b8-6-,12-11-,15-14-,21-20-,29-25-,31-27-,32-28-,37-33+/t44?,45-/m1/s1
C47H78NO9P832.09731100
117218322

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C47H78NO9P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-24-27-31-35-39-47(51)57-45(43-56-58(52,53)55-41-40-48)42-54-46(50)38-34-30-26-23-21-20-22-25-29-33-37-44(49)36-32-28-10-8-6-4-2/h6,8,11-12,14-15,20-21,25-26,28-30,32-33,37,44-45,49H,3-5,7,9-10,13,16-19,22-24,27,31,34-36,38-43,48H2,1-2H3,(H,52,53)/b8-6-,12-11-,15-14-,21-20-,29-25-,30-26-,32-28-,37-33+/t44?,45-/m1/s1
C47H78NO9P832.09731100
117218323

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C47H78NO9P/c1-3-5-7-8-9-10-11-12-13-14-15-18-21-24-27-30-34-38-46(50)54-42-45(43-56-58(52,53)55-41-40-48)57-47(51)39-35-31-28-25-22-19-16-17-20-23-26-29-33-37-44(49)36-32-6-4-2/h6,9-10,12-13,17,19-20,22,26,28-29,31-33,37,44-45,49H,3-5,7-8,11,14-16,18,21,23-25,27,30,34-36,38-43,48H2,1-2H3,(H,52,53)/b10-9-,13-12-,20-17-,22-19-,29-26+,31-28-,32-6-,37-33+/t44?,45-/m1/s1
C47H78NO9P832.09731100
117218324

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C47H78NO9P/c1-3-5-7-8-9-10-11-12-13-14-15-18-22-25-28-31-35-39-47(51)57-45(43-56-58(52,53)55-41-40-48)42-54-46(50)38-34-30-27-24-21-19-16-17-20-23-26-29-33-37-44(49)36-32-6-4-2/h6,9-10,12-13,17,19-21,26-27,29-30,32-33,37,44-45,49H,3-5,7-8,11,14-16,18,22-25,28,31,34-36,38-43,48H2,1-2H3,(H,52,53)/b10-9-,13-12-,20-17-,21-19-,29-26+,30-27-,32-6-,37-33+/t44?,45-/m1/s1
C47H78NO9P832.09731100
117218327

Double-bond stereo

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C47H78NO9P/c1-3-5-7-8-9-10-11-12-13-14-15-16-20-23-26-29-33-37-46(49)53-41-43(42-55-58(51,52)54-40-39-48)56-47(50)38-34-30-27-24-21-18-17-19-22-25-28-32-36-45-44(57-45)35-31-6-4-2/h6,9-10,12-13,18-19,21-22,27-28,30-32,43-45H,3-5,7-8,11,14-17,20,23-26,29,33-42,48H2,1-2H3,(H,51,52)/b10-9-,13-12-,21-18-,22-19-,30-27-,31-6-,32-28-/t43-,44?,45?/m1/s1
C47H78NO9P832.09731100
117218328

Double-bond stereo

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C47H78NO9P/c1-3-5-7-8-9-10-11-12-13-14-15-16-21-24-27-30-34-38-47(50)56-43(42-55-58(51,52)54-40-39-48)41-53-46(49)37-33-29-26-23-20-18-17-19-22-25-28-32-36-45-44(57-45)35-31-6-4-2/h6,9-10,12-13,18-20,22,26,28-29,31-32,43-45H,3-5,7-8,11,14-17,21,23-25,27,30,33-42,48H2,1-2H3,(H,51,52)/b10-9-,13-12-,20-18-,22-19-,29-26-,31-6-,32-28-/t43-,44?,45?/m1/s1
C47H78NO9P832.09731100

Advertisement