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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 22 results

Search term: C40H74NO10P (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
35032460

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(43)51-36(34-49-52(46,47)50-35-37(41)40(44)45)33-48-38(42)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h11,13,17-18,36-37H,3-10,12,14-16,19-35,41H2,1-2H3,(H,44,45)(H,46,47)/b13-11-,18-17-/t36-,37+/m1/s1
C40H74NO10P759.99121000
35032468

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(43)51-36(34-49-52(46,47)50-35-37(41)40(44)45)33-48-38(42)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h14,16-18,36-37H,3-13,15,19-35,41H2,1-2H3,(H,44,45)(H,46,47)/b16-14-,18-17-/t36-,37+/m1/s1
C40H74NO10P759.99111200
35032486

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h11,13,17-18,36-37H,3-10,12,14-16,19-35,41H2,1-2H3,(H,44,45)(H,46,47)/b13-11-,18-17-/t36-,37+/m1/s1
C40H74NO10P759.999900
29368493

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h14,16-18,36-37H,3-13,15,19-35,41H2,1-2H3,(H,44,45)(H,46,47)/b16-14-,18-17-/t36-,37+/m1/s1
C40H74NO10P759.9991100
59695406

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(43)51-36(34-49-52(46,47)50-35-37(41)40(44)45)33-48-38(42)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h13-16,36-37H,3-12,17-35,41H2,1-2H3,(H,44,45)(H,46,47)/b15-13-,16-14-/t36-,37+/m1/s1
C40H74NO10P759.994500
74875724

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-24-26-28-30-32-39(43)51-36(34-49-52(46,47)50-35-37(41)40(44)45)33-48-38(42)31-29-27-25-23-21-14-12-10-8-6-4-2/h10,12,16-17,36-37H,3-9,11,13-15,18-35,41H2,1-2H3,(H,44,45)(H,46,47)/b12-10-,17-16-/t36-,37+/m1/s1
C40H74NO10P759.994400
74875742

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-24-26-28-30-32-39(43)51-36(34-49-52(46,47)50-35-37(41)40(44)45)33-48-38(42)31-29-27-25-23-21-14-12-10-8-6-4-2/h11,13,16-17,36-37H,3-10,12,14-15,18-35,41H2,1-2H3,(H,44,45)(H,46,47)/b13-11-,17-16-/t36-,37+/m1/s1
C40H74NO10P759.994400
74875984

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-21-14-12-10-8-6-4-2/h10,12,16-17,36-37H,3-9,11,13-15,18-35,41H2,1-2H3,(H,44,45)(H,46,47)/b12-10-,17-16-/t36-,37+/m1/s1
C40H74NO10P759.994400
74876010

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-21-14-12-10-8-6-4-2/h11,13,16-17,36-37H,3-10,12,14-15,18-35,41H2,1-2H3,(H,44,45)(H,46,47)/b13-11-,17-16-/t36-,37+/m1/s1
C40H74NO10P759.994400
59695418

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h13-16,36-37H,3-12,17-35,41H2,1-2H3,(H,44,45)(H,46,47)/b15-13-,16-14-/t36-,37+/m1/s1
C40H74NO10P759.993400
59696550

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(43)51-36(34-49-52(46,47)50-35-37(41)40(44)45)33-48-38(42)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h11,13,17-18,36-37H,3-10,12,14-16,19-35,41H2,1-2H3,(H,44,45)(H,46,47)/b13-11+,18-17+/t36-,37+/m1/s1
C40H74NO10P759.991100
59696556

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(43)51-36(34-49-52(46,47)50-35-37(41)40(44)45)33-48-38(42)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h14,16-18,36-37H,3-13,15,19-35,41H2,1-2H3,(H,44,45)(H,46,47)/b16-14+,18-17+/t36-,37+/m1/s1
C40H74NO10P759.991100
59696576

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h11,13,17-18,36-37H,3-10,12,14-16,19-35,41H2,1-2H3,(H,44,45)(H,46,47)/b13-11+,18-17+/t36-,37+/m1/s1
C40H74NO10P759.991100
113376190

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h10,12,16,18,36-37H,3-9,11,13-15,17,19-35,41H2,1-2H3,(H,44,45)(H,46,47)/b12-10-,18-16-/t36-,37+/m1/s1
C40H74NO10P759.991100
113376243

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h9,11,15,17,36-37H,3-8,10,12-14,16,18-35,41H2,1-2H3,(H,44,45)(H,46,47)/b11-9-,17-15-/t36-,37+/m1/s1
C40H74NO10P759.991100
113376350

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-22-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-21-16-14-12-10-8-6-4-2/h12,14,18-19,36-37H,3-11,13,15-17,20-35,41H2,1-2H3,(H,44,45)(H,46,47)/b14-12-,19-18-/t36-,37+/m1/s1
C40H74NO10P759.991100
113376497

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-24-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-23-12-10-8-6-4-2/h11,13,15-16,36-37H,3-10,12,14,17-35,41H2,1-2H3,(H,44,45)(H,46,47)/b13-11-,16-15-/t36-,37+/m1/s1
C40H74NO10P759.991100
113376541

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h15-18,36-37H,3-14,19-35,41H2,1-2H3,(H,44,45)(H,46,47)/b17-15-,18-16-/t36-,37+/m1/s1
C40H74NO10P759.991100
117217258

Double-bond stereo

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-28-37(42)38(43)29-27-31-40(45)51-36(35-50-52(46,47)49-33-32-41)34-48-39(44)30-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,23,25,36-38,42-43H,3-10,12,14-16,18,20-22,24,26-35,41H2,1-2H3,(H,46,47)/b13-11-,19-17-,25-23-/t36-,37?,38?/m1/s1
C40H74NO10P759.991100
117217259

Double-bond stereo

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C40H74NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-28-37(42)38(43)29-27-31-39(44)48-34-36(35-50-52(46,47)49-33-32-41)51-40(45)30-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,23,25,36-38,42-43H,3-10,12,14-16,18,20-22,24,26-35,41H2,1-2H3,(H,46,47)/b13-11-,19-17-,25-23-/t36-,37?,38?/m1/s1
C40H74NO10P759.991100
12

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