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 24 results

Search term: JNTQSSGVHLUIBL (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8087948

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17-,19-,21-,22+,24+,25+,26+,27+/m0/s1
C27H44O6464.6347171400
8131715

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17?,19-,21?,22+,24+,25+,26+,27+/m0/s1
C27H44O6464.63479500
17466550

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17?,19+,21?,22-,24-,25-,26-,27-/m1/s1
C27H44O6464.63479600
9987292

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17+,19+,21+,22-,24-,25-,26-,27-/m1/s1
C27H44O6464.63473200
545776

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3
C27H44O6464.63472100
8965625

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17-,19+,21-,22+,24+,25+,26+,27+/m0/s1
C27H44O6464.63472100
62315134

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17-,19+,21+,22-,24-,25-,26-,27-/m1/s1
C27H44O6464.63472200
62315135

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17+,19+,21-,22-,24-,25-,26-,27-/m1/s1
C27H44O6464.63472200
62315141

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17-,19+,21-,22-,24-,25-,26-,27-/m1/s1
C27H44O6464.63472300
62315152

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17+,19-,21+,22-,24+,25+,26-,27+/m1/s1
C27H44O6464.63472200
62315153

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17-,19-,21+,22-,24+,25+,26-,27+/m1/s1
C27H44O6464.63472200
62315154

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17-,19+,21+,22+,24-,25-,26+,27-/m0/s1
C27H44O6464.63472200
62315155

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17+,19+,21+,22+,24-,25-,26+,27-/m0/s1
C27H44O6464.63472300
62400589

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17+,19-,21+,22+,24+,25+,26+,27+/m0/s1
C27H44O6464.63472200
62400612

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17+,19+,21+,22+,24-,25-,26-,27-/m0/s1
C27H44O6464.63472200
62493565

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17+,19-,21-,22+,24+,25+,26+,27+/m0/s1
C27H44O6464.63472200
62567400

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17-,19-,21+,22+,24+,25+,26+,27+/m0/s1
C27H44O6464.63472300
62569868

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17+,19-,21-,22-,24+,25+,26-,27+/m1/s1
C27H44O6464.63472200
67494256

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17-,19-,21+,22+,24+,25+,26-,27-/m0/s1
C27H44O6464.63471100
12

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