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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 16 results

Search term: QFKRKMXPKBHGGO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4944810

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t15-,16+,17-,18-,19-,21-,22-,23+/m1/s1
C23H32O7420.4965625
10274911

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t15-,16-,17+,18+,19+,21+,22+,23-/m0/s1
C23H32O7420.49651500
8892353

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t15-,16-,17-,18-,19-,21-,22-,23+/m1/s1
C23H32O7420.4963200
8916139

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t15-,16+,17+,18+,19+,21+,22+,23-/m0/s1
C23H32O7420.4963200
4944832

Double-bond stereo

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t15-,16?,17+,18+,19+,21+,22-,23-/m0/s1
C23H32O7420.4962200
8042509

Double-bond stereo

5 of 8 defined stereocentres - 5/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5+/t15?,16-,17?,18+,19+,21+,22+,23?/m0/s1
C23H32O7420.4962100
8064055

Double-bond stereo

5 of 8 defined stereocentres - 5/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5+/t15?,16-,17?,18-,19-,21-,22-,23?/m1/s1
C23H32O7420.4962100
8725453

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5+/t15-,16+,17+,18+,19+,21+,22+,23-/m0/s1
C23H32O7420.4962100
8868773

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5+/t15-,16-,17-,18-,19-,21-,22-,23+/m1/s1
C23H32O7420.4962100
58817543

Double-bond stereo

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t15-,16+,17-,18-,19-,21+,22?,23+/m1/s1
C23H32O7420.4961100
58817545

Double-bond stereo

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t15-,16?,17+,18+,19+,21-,22-,23-/m0/s1
C23H32O7420.4961100
78440084

Double-bond stereo

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t15-,16+,17-,18-,19-,21-,22-,23?/m1/s1
C23H32O7420.4961100
78440476

Double-bond stereo

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t15-,16-,17+,18+,19+,21+,22+,23?/m0/s1
C23H32O7420.4961100
95601804

Double-bond stereo

6 of 8 defined stereocentres - 6/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t15-,16-,17+,18+,19+,21?,22+,23?/m0/s1
C23H32O7420.4961100
95601805

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t15-,16-,17+,18+,19-,21+,22+,23-/m0/s1
C23H32O7420.4961100

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