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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 34 results

Search term: C43H75NO16 (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
392006

18 of 18 defined stereocentres - 18/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,32+,34+,35-,36-,37+,38-,40+,41-,42-,43-/m1/s1
C43H75NO16862.0527727424
3141

0 of 18 defined stereocentres - 0/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3
C43H75NO16862.05272113100
14069

18 of 18 defined stereocentres - 18/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23+,24+,25+,26-,27+,28-,29-,32+,34+,35+,36-,37+,38-,40-,41-,42-,43-/m1/s1
C43H75NO16862.052712900
21112298

18 of 18 defined stereocentres - 18/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23+,24+,25+,26-,27-,28-,29-,32-,34+,35+,36-,37-,38-,40-,41-,42+,43-/m1/s1
C43H75NO16862.0527851561
21343433

16 of 18 defined stereocentres - 16/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)17-18-54-30(45)16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27-,28+,29-,32?,34+,35-,36-,37-,38-,40?,41-,42+,43-/m1/s1
C43H75NO16862.05277300
26943860

17 of 18 defined stereocentres - 17/18 defined
InChI=1/C43H75NO16/c1-15-31-42(10,52)36(49)23(4)34(48)22(3)20-41(9,51)37(24(5)35(25(6)38(50)58-31)59-39-26(7)43(11,53-14)30(45)21-55-39)60-40-29(19-28(44(12)13)27(8)56-40)57-33(47)18-17-32(46)54-16-2/h22-31,35-37,39-40,45,49,51-52H,15-21H2,1-14H3/t22-,23+,24+,25-,26+,27?,28-,29-,30-,31-,35-,36-,37-,39-,40+,41-,42-,43+/m1/s1
C43H75NO16862.05276200
21344431

16 of 18 defined stereocentres - 16/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,32+,34+,35-,36-,37+,38?,40?,41-,42-,43-/m1/s1
C43H75NO16862.05274100
21171819

18 of 18 defined stereocentres - 18/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23+,24+,25+,26-,27-,28-,29-,32-,34+,35+,36-,37-,38-,40-,41-,42+,43-/m0/s1
C43H75NO16862.05272200
32696550

18 of 18 defined stereocentres - 18/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27-,28+,29-,32-,34+,35-,36-,37-,38-,40+,41-,42+,43-/m1/s1
C43H75NO16862.05272100
75932528

17 of 18 defined stereocentres - 17/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,32+,34+,35-,36-,37+,38?,40+,41-,42-,43-/m1/s1
C43H75NO16862.05272300
35555

9 of 18 defined stereocentres - 9/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23?,24+,25?,26-,27?,28?,29-,32?,34+,35?,36-,37?,38-,40?,41-,42?,43-/m1/s1
C43H75NO16862.05272200
2695144

0 of 18 defined stereocentres - 0/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)17-18-54-30(45)16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3
C43H75NO16862.0526999999982100
8094755

10 of 17 defined stereocentres - 10/17 defined
InChI=1/C43H75NO16/c1-14-32-29(21-55-43-41(54-13)40(53-12)39(26(6)57-43)58-27(7)45)17-22(2)15-16-30(46)23(3)18-28(19-34(51-10)52-11)38(24(4)31(47)20-33(48)59-32)60-42-37(50)35(44(8)9)36(49)25(5)56-42/h22-26,28-29,32,34-43,49-50H,14-21H2,1-13H3/t22?,23?,24?,25-,26-,28?,29?,32?,35+,36-,37-,38?,39-,40-,41+,42+,43-/m1/s1
C43H75NO16862.05272100
8616083

18 of 18 defined stereocentres - 18/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,32+,34+,35-,36-,37+,38-,40+,41+,42-,43-/m1/s1
C43H75NO16862.05272100
17465600

15 of 18 defined stereocentres - 15/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,32+,34+,35-,36-,37+,38?,40?,41-,42?,43-/m1/s1
C43H75NO16862.05272100
401947

10 of 18 defined stereocentres - 10/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23?,24+,25+,26-,27?,28?,29-,32?,34+,35?,36-,37?,38-,40?,41-,42?,43-/m1/s1
C43H75NO16862.05271100
78425314

17 of 18 defined stereocentres - 17/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,32?,34+,35-,36-,37+,38-,40+,41-,42-,43-/m0/s1
C43H75NO16862.05271100
113619305

18 of 18 defined stereocentres - 18/18 defined
InChI=1/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23+,24+,25+,26-,27+,28-,29-,32-,34+,35+,36-,37+,38-,40-,41-,42-,43+/m1/s1
C43H75NO16862.05271100
12

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