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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
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Found 74 results

Search term: C44H76NO8P (Found by molecular formula)
1234
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24766868

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8-11,14-17,20-23,42H,6-7,12-13,18-19,24-41H2,1-5H3/b10-8-,11-9-,16-14-,17-15-,22-20-,23-21-/t42-/m1/s1
C44H76NO8P778.0499202000
24767383

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-26-17-15-13-11-9-7-2/h8,10,14,16,19-20,22-23,25,27,30,32,42H,6-7,9,11-13,15,17-18,21,24,26,28-29,31,33-41H2,1-5H3/b10-8-,16-14-,20-19-,23-22-,27-25-,32-30-/t42-/m1/s1
C44H76NO8P778.0499131500
24766568

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h8,10,14,16,19-20,22-23,25,27,31,33,42H,6-7,9,11-13,15,17-18,21,24,26,28-30,32,34-41H2,1-5H3/b10-8-,16-14-,20-19-,23-22-,27-25-,33-31-/t42-/m1/s1
C44H76NO8P778.0499121300
24766599

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h13-16,19-20,22-23,25,27,31,33,42H,6-12,17-18,21,24,26,28-30,32,34-41H2,1-5H3/b15-13-,16-14-,20-19-,23-22-,27-25-,33-31-/t42-/m1/s1
C44H76NO8P778.0499111100
24766600

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h8,10,13-16,19-20,22-23,25,27,42H,6-7,9,11-12,17-18,21,24,26,28-41H2,1-5H3/b10-8-,15-13-,16-14-,20-19-,23-22-,27-25-/t42-/m1/s1
C44H76NO8P778.0499111100
24766686

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h8,10,14,16-17,19-21,23,25,29,31,42H,6-7,9,11-13,15,18,22,24,26-28,30,32-41H2,1-5H3/b10-8-,16-14-,19-17-,21-20-,25-23-,31-29-/t42-/m1/s1
C44H76NO8P778.0499111100
24766803

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h9,11,14-17,20-23,27,29,42H,6-8,10,12-13,18-19,24-26,28,30-41H2,1-5H3/b11-9-,16-14-,17-15-,22-20-,23-21-,29-27-/t42-/m1/s1
C44H76NO8P778.0499111100
24766834

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h14-17,20-23,26-29,42H,6-13,18-19,24-25,30-41H2,1-5H3/b16-14-,17-15-,22-20-,23-21-,28-26-,29-27-/t42-/m1/s1
C44H76NO8P778.0499111100
24766835

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h9,11,14-17,20-23,26,28,42H,6-8,10,12-13,18-19,24-25,27,29-41H2,1-5H3/b11-9-,16-14-,17-15-,22-20-,23-21-,28-26-/t42-/m1/s1
C44H76NO8P778.0499111100
24766867

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,27,29,42H,6-7,9,11-13,18-19,24-26,28,30-41H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-,29-27-/t42-/m1/s1
C44H76NO8P778.0499111100
24766899

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,26,28,42H,6-7,9,11-13,18-19,24-25,27,29-41H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-,28-26-/t42-/m1/s1
C44H76NO8P778.0499111100
24767157

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-25-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-24-19-17-15-13-11-9-7-2/h8,10,14,16-17,19-21,23,25,28,30,42H,6-7,9,11-13,15,18,22,24,26-27,29,31-41H2,1-5H3/b10-8-,16-14-,19-17-,21-20-,25-23-,30-28-/t42-/m1/s1
C44H76NO8P778.0499111100
24767318

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-26-17-15-13-11-9-7-2/h13-16,19-20,22-23,25,27,30,32,42H,6-12,17-18,21,24,26,28-29,31,33-41H2,1-5H3/b15-13-,16-14-,20-19-,23-22-,27-25-,32-30-/t42-/m1/s1
C44H76NO8P778.0499111100
24767351

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-26-17-15-13-11-9-7-2/h8,10,13-16,19-20,22-23,25,27,42H,6-7,9,11-12,17-18,21,24,26,28-41H2,1-5H3/b10-8-,15-13-,16-14-,20-19-,23-22-,27-25-/t42-/m1/s1
C44H76NO8P778.0499111100
4946694

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C44H76NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8-11,14-17,20-23,42H,6-7,12-13,18-19,24-41H2,1-5H3/b10-8-,11-9-,16-14-,17-15-,22-20-,23-21-
C44H76NO8P778.04998800
74850494

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C44H76NO8P/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-25-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45-3)53-44(47)37-35-33-31-29-27-24-17-15-13-11-9-7-5-2/h12,14-15,17-19,21-22,25-26,30,32,42,45H,4-11,13,16,20,23-24,27-29,31,33-41H2,1-3H3,(H,48,49)/b14-12-,17-15-,19-18-,22-21-,26-25-,32-30-
C44H76NO8P778.04993300
74850521

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C44H76NO8P/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-25-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45-3)53-44(47)37-35-33-31-29-27-24-17-15-13-11-9-7-5-2/h6,8,12,14-15,17-19,21-22,25-26,42,45H,4-5,7,9-11,13,16,20,23-24,27-41H2,1-3H3,(H,48,49)/b8-6-,14-12-,17-15-,19-18-,22-21-,26-25-
C44H76NO8P778.04993300
74850547

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C44H76NO8P/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-25-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45-3)53-44(47)37-35-33-31-29-27-24-17-15-13-11-9-7-5-2/h6,8,12,14,18-19,21-22,25-26,30,32,42,45H,4-5,7,9-11,13,15-17,20,23-24,27-29,31,33-41H2,1-3H3,(H,48,49)/b8-6-,14-12-,19-18-,22-21-,26-25-,32-30-
C44H76NO8P778.04993300
74850725

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C44H76NO8P/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3)4)40-50-43(46)36-34-32-30-28-26-18-16-14-12-10-8-6-2/h7,9,13,15,19-20,22-23,25,27,31,33,42H,5-6,8,10-12,14,16-18,21,24,26,28-30,32,34-41H2,1-4H3,(H,48,49)/b9-7-,15-13-,20-19-,23-22-,27-25-,33-31-
C44H76NO8P778.04993300
74851365

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C44H76NO8P/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-27-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3)4)53-44(47)37-35-33-31-29-26-18-16-14-12-10-8-6-2/h7,9,13,15,19-20,22-23,25,27,30,32,42H,5-6,8,10-12,14,16-18,21,24,26,28-29,31,33-41H2,1-4H3,(H,48,49)/b9-7-,15-13-,20-19-,23-22-,27-25-,32-30-
C44H76NO8P778.04993300
1234

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