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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
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Found 13 results

Search term: C40H81NO5 (Found by molecular formula)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
28533104

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C40H81NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-38(44)40(46)41-36(35-42)39(45)37(43)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h36-39,42-45H,3-35H2,1-2H3,(H,41,46)/t36-,37+,38?,39-/m0/s1
C40H81NO5656.07485600
8898311

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C40H81NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-38(44)40(46)41-36(35-42)39(45)37(43)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h36-39,42-45H,3-35H2,1-2H3,(H,41,46)/t36-,37+,38+,39-/m0/s1
C40H81NO5656.07484300
28533091

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C40H81NO5/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-38(44)40(46)41-36(35-42)39(45)37(43)33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h36-39,42-45H,3-35H2,1-2H3,(H,41,46)/t36-,37+,38?,39-/m0/s1
C40H81NO5656.07484500
65328933

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C40H81NO5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-24-27-30-33-38(44)40(46)41-36(34-42)39(45)37(43)32-29-26-23-21-18-19-22-25-28-31-35(2)3/h35-39,42-45H,4-34H2,1-3H3,(H,41,46)/t36-,37+,38+,39-/m0/s1
C40H81NO5656.07483300
9939587

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C40H81NO5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-27-30-33-38(44)40(46)41-36(34-42)39(45)37(43)32-29-26-23-21-20-22-25-28-31-35(2)3/h35-39,42-45H,4-34H2,1-3H3,(H,41,46)/t36-,37+,38+,39-/m0/s1
C40H81NO5656.07483200
30785614

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C40H81NO5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-27-30-33-38(44)40(46)41-36(34-42)39(45)37(43)32-29-26-23-21-20-22-25-28-31-35(2)3/h35-39,42-45H,4-34H2,1-3H3,(H,41,46)/t36-,37+,38?,39-/m0/s1
C40H81NO5656.07483400
10189694

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C40H81NO5/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-26-28-30-32-34-38(44)40(46)41-36(35-42)39(45)37(43)33-31-29-27-25-14-12-10-8-6-4-2/h36-39,42-45H,3-35H2,1-2H3,(H,41,46)/t36-,37+,38+,39-/m0/s1
C40H81NO5656.07482200
10481177

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C40H81NO5/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-24-26-28-30-32-36(43)34-39(45)40(46)41-37(35-42)38(44)33-31-29-27-25-22-14-12-10-8-6-4-2/h36-39,42-45H,3-35H2,1-2H3,(H,41,46)
C40H81NO5656.07482200
27024451

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C40H81NO5/c1-4-5-6-7-8-9-10-11-12-13-14-17-21-24-27-30-33-38(44)40(46)41-36(34-42)39(45)37(43)32-29-26-23-20-18-15-16-19-22-25-28-31-35(2)3/h35-39,42-45H,4-34H2,1-3H3,(H,41,46)/t36-,37+,38+,39-/m0/s1
C40H81NO5656.07482200
35013931

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C40H81NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-38(44)40(46)41-36(35-42)39(45)37(43)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h36-39,42-45H,3-35H2,1-2H3,(H,41,46)
C40H81NO5656.07481100
30779183

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C40H81NO5/c1-3-5-7-9-11-13-15-17-19-21-25-29-33-38(44)40(46)37(35-42)41-39(45)34-30-26-22-24-28-32-36(43)31-27-23-20-18-16-14-12-10-8-6-4-2/h36-38,40,42-44,46H,3-35H2,1-2H3,(H,41,45)/t36-,37+,38-,40+/m1/s1
C40H81NO5656.07481100
67171405

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C40H81NO5/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-26-28-30-32-34-38(44)40(46)41-36(35-42)39(45)37(43)33-31-29-27-25-14-12-10-8-6-4-2/h36-39,42-45H,3-35H2,1-2H3,(H,41,46)/t36-,37+,38?,39-/m0/s1
C40H81NO5656.07481100
129243758

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C40H81NO5/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-38(44)40(46)41-36(35-42)39(45)37(43)33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h36-39,42-45H,3-35H2,1-2H3,(H,41,46)/t36-,37+,38+,39-/m0/s1
C40H81NO5656.07481100

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