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 10 results

Search term: C45H82NO7P (Found by molecular formula)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24769275

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,22-23,26,28,37,40,44H,3-10,12,14-16,18,20-21,24-25,27,29-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b13-11-,19-17-,23-22-,28-26-,40-37-/t44-/m1/s1
C45H82NO7P780.10889900
24769054

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)51-42-44(43-53-54(48,49)52-41-39-46)50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,22-23,26,28,37,40,44H,3-10,12,14-16,18,20-21,24-25,27,29-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b13-11-,19-17-,23-22-,28-26-,40-37-/t44-/m1/s1
C45H82NO7P780.10885500
59699168

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)51-42-44(43-53-54(48,49)52-41-39-46)50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,22-23,26,28,37,40,44H,3-10,12,14-16,18,20-21,24-25,27,29-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b13-11+,19-17+,23-22+,28-26+,40-37+/t44-/m1/s1
C45H82NO7P780.10881100
59699765

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,22-23,26,28,37,40,44H,3-10,12,14-16,18,20-21,24-25,27,29-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b13-11+,19-17+,23-22+,28-26+,40-37+/t44-/m1/s1
C45H82NO7P780.10881100
113375962

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-40-50-42-44(43-52-54(48,49)51-41-39-46)53-45(47)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,12,14,18,20,24,26,30,32,44H,3-5,7,9-11,13,15-17,19,21-23,25,27-29,31,33-43,46H2,1-2H3,(H,48,49)/b8-6-,14-12-,20-18-,26-24-,32-30-/t44-/m1/s1
C45H82NO7P780.10881100
113376027

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-40-50-42-44(43-52-54(48,49)51-41-39-46)53-45(47)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,24,26,30,32,37,40,44H,3-11,13,15-17,19,21-23,25,27-29,31,33-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b14-12-,20-18-,26-24-,32-30-,40-37-/t44-/m1/s1
C45H82NO7P780.10881100
17593783

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C45H82NO7P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-45(47)53-44(43-52-54(48,49)51-42-39-46(3,4)5)38-41-50-40-36-34-32-30-28-26-21-19-17-15-13-11-9-7-2/h22-25,27,29,31,33,35,37,44H,6-21,26,28,30,32,34,36,38-43H2,1-5H3/b23-22+,25-24+,29-27+,33-31+,37-35+
C45H82NO7P780.10881100
24608297

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h17,19,22-23,26,28,32,34,37,40,44H,3-16,18,20-21,24-25,27,29-31,33,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b19-17-,23-22-,28-26-,34-32-,40-37+
C45H82NO7P780.10881600
24608305

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-40-50-42-44(43-52-54(48,49)51-41-39-46)53-45(47)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h14,16,20,22,26,28,32,34,37,40,44H,3-13,15,17-19,21,23-25,27,29-31,33,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b16-14-,22-20-,28-26-,34-32-,40-37+
C45H82NO7P780.10881300
24608451

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-18-16-14-12-10-8-6-4-2/h20-21,23-24,26,28,32,34,37,40,44H,3-19,22,25,27,29-31,33,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b21-20-,24-23-,28-26-,34-32-,40-37+
C45H82NO7P780.10881200

Advertisement