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 10 results

Search term: VGSSUFQMXBFFTM (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2300310

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C29H52O3/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-26,30-32H,7-17H2,1-6H3/t19-,20-,21+,22+,23-,24+,25+,26-,27-,28-,29+/m1/s1
C29H52O3448.72138352800
550984

0 of 11 defined stereocentres - 0/11 defined
InChI=1/C29H52O3/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-26,30-32H,7-17H2,1-6H3
C29H52O3448.721410800
17466549

9 of 11 defined stereocentres - 9/11 defined
InChI=1/C29H52O3/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-26,30-32H,7-17H2,1-6H3/t19-,20-,21+,22+,23-,24?,25?,26-,27-,28-,29+/m1/s1
C29H52O3448.72148400
20056547

8 of 11 defined stereocentres - 8/11 defined
InChI=1/C29H52O3/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-26,30-32H,7-17H2,1-6H3/t19-,20-,21?,22+,23-,24+,25+,26?,27-,28-,29?/m1/s1
C29H52O3448.72146300
13077785

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C29H52O3/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-26,30-32H,7-17H2,1-6H3/t19-,20+,21+,22+,23-,24+,25+,26-,27-,28-,29+/m1/s1
C29H52O3448.72143300
29216361

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C29H52O3/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-26,30-32H,7-17H2,1-6H3/t19-,20+,21+,22+,23-,24+,25+,26+,27-,28-,29+/m1/s1
C29H52O3448.72142200
67177890

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C29H52O3/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-26,30-32H,7-17H2,1-6H3/t19-,20-,21+,22+,23-,24+,25+,26-,27-,28-,29-/m1/s1
C29H52O3448.72141100
113611257

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C29H52O3/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-26,30-32H,7-17H2,1-6H3/t19-,20-,21+,22+,23+,24+,25-,26-,27-,28+,29+/m1/s1
C29H52O3448.72141100
17233508

3 of 11 defined stereocentres - 3/11 defined
InChI=1/C29H52O3/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-26,30-32H,7-17H2,1-6H3/t19?,20?,21-,22?,23?,24?,25?,26+,27?,28?,29-/m0/s1
C29H52O3448.72141100
17626440

8 of 11 defined stereocentres - 8/11 defined
InChI=1/C29H52O3/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-26,30-32H,7-17H2,1-6H3/t19-,20-,21+,22?,23-,24?,25?,26+,27-,28-,29+/m1/s1
C29H52O3448.72141100

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