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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: QQCOAAFKJZXJFP (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4446231

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6-,15-13+/t17-,18-,19+,20-,22+/m1/s1
C22H38O5382.5341353530
29341959

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6-,15-13+/t17-,18-,19+,20-,22-/m1/s1
C22H38O5382.5341171800
8152803

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6-,15-13+/t17-,18?,19+,20-,22+/m1/s1
C22H38O5382.534111900
10443808

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6+,15-13+
C22H38O5382.5341104000
21927673

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6-,15-13+
C22H38O5382.53419400
4939144

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6+,15-13-/t17-,18?,19+,20-,22-/m0/s1
C22H38O5382.53415400
78221291

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6-,15-13+/t17-,18-,19+,20-,22+/m0/s1
C22H38O5382.53413300
78431084

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6+,15-13+/t17-,18?,19+,20-,22+/m1/s1
C22H38O5382.53411100
78433567

Double-bond stereo

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/t17-,18?,19?,20?,22?/m0/s1
C22H38O5382.53411100
79952230

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6+,15-13+/t17-,18-,19+,20-,22+/m1/s1
C22H38O5382.53411100
79952303

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6+,15-13+/t17-,18+,19+,20-,22-/m1/s1
C22H38O5382.53411100
95642112

Double-bond stereo

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6+,15-13u/t17?,18-,19?,20?,22-/m1/s1
C22H38O5382.53411100
115046388

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6+,15-13+/t17-,18?,19+,20-,22?/m1/s1
C22H38O5382.53411100
60960100

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6-,15-13+/t17-,18-,19-,20-,22+/m1/s1
C22H38O5382.53411100
62483749

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6?,15-13+/t17-,18-,19+,20-,22+/m1/s1
C22H38O5382.53411100
62488004

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6?,15-13+/t17-,18+,19+,20-,22-/m1/s1
C22H38O5382.53411100
12

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