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
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Found 21 results

Search term: ISJVDMWNISUFRJ (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
92089

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14+,15+,16+,18+,19+/m1/s1
C19H28O272.425655250
9240751

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13?,14-,15-,16-,18-,19-/m0/s1
C19H28O272.4252211534
209162

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3
C19H28O272.425141600
17460951

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14+,15?,16?,18+,19+/m1/s1
C19H28O272.4259500
4938008

1 of 6 defined stereocentres - 1/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14?,15?,16?,18?,19?/m1/s1
C19H28O272.4256600
67865420

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14-,15+,16+,18-,19-/m0/s1
C19H28O272.4254500
5140695

3 of 6 defined stereocentres - 3/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14?,15?,16?,18+,19+/m1/s1
C19H28O272.4252100
26404028

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13?,14?,15?,16?,18-,19-/m0/s1
C19H28O272.4252100
1390066

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14+,15-,16-,18+,19-/m1/s1
C19H28O272.4252100
1390068

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14+,15+,16-,18+,19-/m1/s1
C19H28O272.4252100
1390069

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14+,15-,16+,18+,19-/m1/s1
C19H28O272.4252100
1390070

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14+,15+,16+,18+,19-/m1/s1
C19H28O272.4252100
10042514

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14-,15+,16-,18+,19-/m1/s1
C19H28O272.4252100
10042515

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14-,15+,16-,18+,19+/m1/s1
C19H28O272.4252100
10042516

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14-,15+,16+,18+,19-/m1/s1
C19H28O272.4252100
10042517

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14-,15+,16+,18+,19+/m1/s1
C19H28O272.4252100
30650762

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13?,14?,15?,16?,18-,19-/m1/s1
C19H28O272.4251100
78429938

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13?,14-,15+,16+,18+,19+/m1/s1
C19H28O272.4251100
111310581

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14-,15+,16+,18-,19-/m1/s1
C19H28O272.4251100
113598735

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14+,15?,16?,18+,19+/m0/s1
C19H28O272.4251100
12

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