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: XGZQDBRFMPJPBO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2114387

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3
C27H38O3410.5888211800
17460887

3 of 8 defined stereocentres - 3/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20?,21-,22?,23?,24?,25+,26+,27?/m1/s1
C27H38O3410.58884100
1151229

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21+,22+,23+,24+,25-,26-,27+/m1/s1
C27H38O3410.58883200
10045549

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21+,22+,23-,24+,25+,26+,27+/m1/s1
C27H38O3410.58883200
10045552

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21-,22-,23+,24-,25-,26-,27+/m0/s1
C27H38O3410.58883200
10046678

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21-,22+,23-,24+,25+,26+,27+/m1/s1
C27H38O3410.58883200
10046679

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21-,22+,23-,24+,25+,26+,27-/m1/s1
C27H38O3410.58882100
10046680

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21+,22-,23+,24-,25-,26-,27-/m0/s1
C27H38O3410.58882100
10046681

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21+,22-,23+,24-,25-,26-,27+/m0/s1
C27H38O3410.58882100
10045550

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21+,22+,23-,24+,25+,26+,27-/m1/s1
C27H38O3410.58882100
10045551

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21-,22-,23+,24-,25-,26-,27-/m0/s1
C27H38O3410.58882100
1386241

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21+,22+,23+,24+,25+,26-,27+/m1/s1
C27H38O3410.58882100
62493174

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21+,22+,23-,24-,25+,26+,27+/m1/s1
C27H38O3410.58882200
62493175

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21+,22+,23-,24+,25-,26-,27+/m0/s1
C27H38O3410.58882200
62634904

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O3/c1-17(28)27-12-6-5-7-20(27)16-24-22-9-8-19-15-21(30-18(2)29)10-13-25(19,3)23(22)11-14-26(24,27)4/h5-6,8,20-24H,7,9-16H2,1-4H3/t20-,21+,22+,23+,24-,25-,26-,27+/m0/s1
C27H38O3410.58882200

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