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 18 results

Search term: VGLOFWHLPMVSBF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
66293

5 of 7 defined stereocentres - 5/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16-,17+,18+,19?,20?,21+/m1/s1
C21H22O6370.3958302600
17340387

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16-,17+,18+,19?,20-,21+/m1/s1
C21H22O6370.3958151500
283422

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3
C21H22O6370.395810500
8746567

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16-,17+,18+,19-,20?,21+/m1/s1
C21H22O6370.39587300
5426658

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16-,17+,18+,19-,20-,21+/m1/s1
C21H22O6370.39584200
5426656

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16-,17+,18+,19-,20+,21+/m1/s1
C21H22O6370.39584200
5426657

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16-,17+,18+,19+,20-,21+/m1/s1
C21H22O6370.39582100
5426655

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16-,17+,18+,19+,20+,21+/m1/s1
C21H22O6370.39582100
23941307

5 of 7 defined stereocentres - 5/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16?,17+,18+,19?,20-,21+/m1/s1
C21H22O6370.39582100
62615902

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16-,17-,18+,19+,20+,21+/m0/s1
C21H22O6370.39582200
27473109

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16-,17+,18+,19?,20+,21+/m1/s1
C21H22O6370.39582100
57425936

2 of 7 defined stereocentres - 2/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15?,16-,17?,18?,19?,20?,21+/m1/s1
C21H22O6370.39581100
60958880

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16-,17+,18?,19-,20+,21+/m1/s1
C21H22O6370.39581100
103885010

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16-,17+,18-,19-,20+,21+/m1/s1
C21H22O6370.39581100
113607947

5 of 7 defined stereocentres - 5/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16-,17+,18+,19?,20?,21+/m0/s1
C21H22O6370.39581100
128763891

5 of 7 defined stereocentres - 5/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16+,17-,18+,19?,20?,21-/m0/s1
C21H22O6370.39581100
128924976

5 of 7 defined stereocentres - 5/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16+,17+,18-,19?,20?,21+/m1/s1
C21H22O6370.39581100
24589460

3 of 7 defined stereocentres - 3/7 defined
InChI=1/C21H22O6/c1-22-21-18-17(26-20(27-18)14-10-6-3-7-11-14)16-15(24-21)12-23-19(25-16)13-8-4-2-5-9-13/h2-11,15-21H,12H2,1H3/t15-,16?,17-,18+,19?,20?,21?/m0/s1
C21H22O6370.39581100

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