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 15 results

Search term: KIDQUNOGEXTBNB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17466648

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19+,20+,21?,22?,24-,25-,26-,27-/m0/s1
C27H42O3414.62069500
229863

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3
C27H42O3414.62066900
10050271

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19+,20+,21-,22-,24-,25-,26-,27-/m0/s1
C27H42O3414.62063200
10050272

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19+,20+,21+,22+,24-,25-,26-,27-/m0/s1
C27H42O3414.62062100
10050273

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19+,20+,21-,22+,24-,25-,26-,27-/m0/s1
C27H42O3414.62062100
62320663

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19+,20-,21-,22+,24-,25-,26+,27+/m0/s1
C27H42O3414.62062200
1395899

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19-,20+,21+,22+,24-,25-,26-,27-/m0/s1
C27H42O3414.62062100
1395900

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19-,20+,21+,22-,24-,25-,26-,27-/m0/s1
C27H42O3414.62062100
1395901

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19-,20+,21-,22+,24-,25-,26-,27-/m0/s1
C27H42O3414.62062100
1395902

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19-,20+,21-,22-,24-,25-,26-,27-/m0/s1
C27H42O3414.62062100
8749240

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19+,20-,21+,22+,24+,25+,26+,27+/m1/s1
C27H42O3414.62062100
10050270

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19+,20+,21+,22-,24-,25-,26-,27-/m0/s1
C27H42O3414.62062100
62680078

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19+,20-,21+,22-,24-,25-,26+,27+/m0/s1
C27H42O3414.62062200
113598295

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19+,20+,21?,22?,24-,25-,26-,27-/m1/s1
C27H42O3414.62061100
62366866

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C27H42O3/c1-16(15-28)5-8-23-17(2)25-24(30-23)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16,19-22,24-25,28-29H,5,7-15H2,1-4H3/t16-,19-,20-,21+,22-,24+,25+,26-,27-/m0/s1
C27H42O3414.62061100

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