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 16 results

Search term: PSOUXXNNRFNUAY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10264346

17 of 17 defined stereocentres - 17/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19+,20-,21+,22+,23-,24+,25-,26+,27-,28+,29-,30+,33+,34+,35+,36-/m0/s1
C36H62O10654.8715343200
54868902

16 of 17 defined stereocentres - 16/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19+,20-,21+,22+,23-,24+,25-,26+,27-,28+,29-,30?,33+,34+,35+,36-/m0/s1
C36H62O10654.87154300
101935825

15 of 17 defined stereocentres - 15/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19+,20-,21+,22?,23-,24+,25-,26+,27-,28+,29?,30+,33+,34+,35+,36-/m0/s1
C36H62O10654.87153300
10264345

17 of 17 defined stereocentres - 17/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19+,20-,21+,22+,23-,24-,25-,26+,27-,28+,29-,30+,33+,34+,35+,36-/m0/s1
C36H62O10654.87153510
8276350

16 of 17 defined stereocentres - 16/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19+,20-,21+,22+,23-,24-,25-,26+,27-,28+,29-,30+,33+,34+,35+,36?/m0/s1
C36H62O10654.87152100
82827554

17 of 17 defined stereocentres - 17/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19+,20-,21+,22+,23-,24+,25-,26+,27-,28+,29-,30+,33+,34+,35+,36-/m1/s1
C36H62O10654.87152300
58802466

15 of 17 defined stereocentres - 15/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19+,20-,21+,22?,23-,24+,25-,26+,27-,28+,29?,30+,33+,34-,35+,36-/m0/s1
C36H62O10654.87152200
78431735

7 of 17 defined stereocentres - 7/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18?,19?,20?,21?,22-,23?,24?,25+,26?,27?,28?,29+,30?,33-,34-,35-,36+/m1/s1
C36H62O10654.87151100
78431931

17 of 17 defined stereocentres - 17/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19-,20-,21+,22-,23+,24+,25+,26+,27+,28+,29-,30-,33+,34+,35-,36-/m0/s1
C36H62O10654.87151100
78433742

0 of 17 defined stereocentres - 0/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3
C36H62O10654.87151100
107450974

16 of 17 defined stereocentres - 16/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19+,20-,21+,22?,23-,24+,25-,26+,27-,28+,29-,30+,33+,34+,35+,36-/m0/s1
C36H62O10654.87151100
113612215

17 of 17 defined stereocentres - 17/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19-,20+,21-,22-,23+,24-,25-,26-,27+,28+,29-,30+,33-,34-,35-,36+/m1/s1
C36H62O10654.87151100
114391933

17 of 17 defined stereocentres - 17/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19-,20-,21-,22+,23+,24+,25+,26-,27-,28+,29+,30+,33+,34-,35+,36+/m0/s1
C36H62O10654.87151100
114816394

17 of 17 defined stereocentres - 17/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19-,20+,21-,22+,23+,24-,25+,26-,27+,28-,29-,30-,33-,34+,35-,36+/m1/s1
C36H62O10654.87151100
128434087

16 of 17 defined stereocentres - 16/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18?,19-,20-,21-,22+,23+,24+,25+,26-,27-,28+,29+,30+,33+,34-,35+,36+/m0/s1
C36H62O10654.87151100
128910399

16 of 17 defined stereocentres - 16/17 defined
InChI=1/C36H62O10/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8)14-11-24(46-36)32(3,4)43)9-13-34(25,6)35(22,7)16-20(29(31)33)44-30-28(42)27(41)26(40)21(17-37)45-30/h18-30,37-43H,9-17H2,1-8H3/t18-,19+,20-,21+,22+,23-,24+,25-,26+,27-,28+,29?,30+,33+,34+,35+,36-/m0/s1
C36H62O10654.87151100

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