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 16 results

Search term: OSENKJZWYQXHBN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2497520

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19+,20+,21-,22+,23+,24+,26+,27-/m1/s1
C27H44O2400.6371313500
8062928

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19+,20+,21-,22+,23+,24?,26+,27-/m1/s1
C27H44O2400.6371111100
17224318

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19?,20+,21-,22+,23+,24+,26+,27-/m1/s1
C27H44O2400.637193600
24681267

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19+,20+,21-,22+,23+,24-,26+,27-/m1/s1
C27H44O2400.63719800
7826148

8 of 9 defined stereocentres - 8/9 defined

Non-standard isotope
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19+,20+,21-,22+,23+,24?,26+,27-/m1/s1/i2D3,3D3
C27H38D6O2406.6748800
8413154

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19?,20+,21-,22+,23+,24-,26+,27-/m1/s1
C27H44O2400.63713200
8425904

6 of 9 defined stereocentres - 6/9 defined
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17?,19-,20?,21+,22-,23-,24?,26-,27+/m0/s1
C27H44O2400.63712100
29401484

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19+,20+,21?,22+,23+,24+,26+,27-/m1/s1
C27H44O2400.63712300
62598604

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19-,20+,21-,22-,23+,24-,26-,27+/m0/s1
C27H44O2400.63712300
107444671

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17?,19-,20-,21-,22-,23-,24+,26-,27+/m0/s1
C27H44O2400.63712300
111310497

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19+,20+,21-,22+,23+,24+,26+,27-/m0/s1
C27H44O2400.63711100
114816169

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17-,19+,20-,21-,22+,23+,24+,26-,27+/m1/s1
C27H44O2400.63711100
128771502

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C27H44O2/c1-17(6-11-24-25(2,3)29-24)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28H,6,8-16H2,1-5H3/t17?,19-,20-,21+,22-,23-,24-,26-,27+/m0/s1
C27H44O2400.63711100

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