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 645 results

Search term: C21H28O5 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5552


7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1
C21H28O5360.44413119718043113
193441


6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1
C21H28O5360.4441221166914135316
5633

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H28O5/c1-20-7-6-13(24)8-12(20)2-3-14-15-4-5-16(18(26)10-22)21(15,11-23)9-17(25)19(14)20/h8,11,14-17,19,22,25H,2-7,9-10H2,1H3/t14-,15-,16+,17-,19+,20-,21+/m0/s1
C21H28O5360.44410413425901131
9420378

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16?,18+,19-,20-,21-/m0/s1
C21H28O5360.444321107723
454849

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3
C21H28O5360.444254500
4444880

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H28O5/c1-7-8-9-14-13(3)17(11-16(14)22)26-20(24)18-15(21(18,4)5)10-12(2)19(23)25-6/h7-8,10,15,17-18H,9,11H2,1-6H3/b8-7-,12-10+/t15-,17+,18+/m1/s1
C21H28O5360.444252600
62035

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H28O5/c1-19-9-13(18(24)25)15(22)8-11(19)4-5-12-14-6-7-21(3,26)20(14,2)10-16(23)17(12)19/h8-9,12,14,16-17,23,26H,4-7,10H2,1-3H3,(H,24,25)/t12-,14-,16-,17+,19-,20-,21-/m0/s1
C21H28O5360.444242400
100484

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H28O5/c1-18-7-5-13(23)9-12(18)3-4-15-14-6-8-20(25,16(24)11-22)19(14,2)10-17-21(15,18)26-17/h9,14-15,17,22,25H,3-8,10-11H2,1-2H3/t14-,15-,17-,18-,19-,20-,21+/m0/s1
C21H28O5360.444242600
10347062

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C21H28O5/c1-10(2)11-9-12-13(15(23)14(11)22)21-8-6-7-20(3,4)18(21)17(16(12)25-5)26-19(21)24/h9-10,16-18,22-23H,6-8H2,1-5H3/t16-,17+,18-,21-/m0/s1
C21H28O5360.444232100
26564157
InChI=1/C21H28O5/c1-23-13-11-17-3-7-20(8-4-17)25-15-19(22)16-26-21-9-5-18(6-10-21)12-14-24-2/h3-10,19,22H,11-16H2,1-2H3
C21H28O5360.444192200
195030

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h3-4,9,14-16,18,22,24,26H,5-8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1
C21H28O5360.444182500
196280

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,11,14-16,18,24,26H,3-8,10H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1
C21H28O5360.444171400
2940341

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H28O5/c1-6-20(17(22)15-12-10-9-11-13-15)16(14(4)5)21(20,18(23)25-7-2)19(24)26-8-3/h9-14,16H,6-8H2,1-5H3
C21H28O5360.44402161100
33823864

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C21H28O5/c1-13-7-10-21-12-25-19(23)15(21)5-4-6-16(21)20(13,2)9-8-14-11-17(24-3)26-18(14)22/h5,11,13,16-17H,4,6-10,12H2,1-3H3/t13-,16-,17?,20+,21-/m1/s1
C21H28O5360.444151200
21667701

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H28O5/c1-6-7-8-9-10-17-13(2)16-11-12-18(25-15(4)20(22)24-5)14(3)19(16)26-21(17)23/h11-12,15H,6-10H2,1-5H3
C21H28O5360.444151100
2172761
InChI=1/C21H28O5/c1-4-23-18-9-5-6-10-19(18)24-15-13-22-14-16-25-20-11-7-8-12-21(20)26-17(2)3/h5-12,17H,4,13-16H2,1-3H3
C21H28O5360.44402151000
4574426

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C21H28O5/c1-20-7-6-12(23)8-11(20)2-3-13-14-4-5-15(16(24)10-22)21(14)9-17(18(13)20)26-19(21)25/h8,13-15,17-19,22,25H,2-7,9-10H2,1H3/t13-,14-,15+,17-,18+,19?,20-,21+/m0/s1
C21H28O5360.44414800
10049951

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H28O5/c1-5-6-7-8-16(23)25-15-10-12(3)17-14(22)9-11(2)18(17)20-19(15)13(4)21(24)26-20/h9,13,15,18-20H,5-8,10H2,1-4H3/t13-,15-,18-,19+,20+/m0/s1
C21H28O5360.44414900
4642484

4 of 7 defined stereocentres - 4/7 defined
InChI=1/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14?,15?,16-,18?,19-,20-,21-/m0/s1
C21H28O5360.444121217921110
454792

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C21H28O5/c1-20-7-6-13(24)8-12(20)2-3-14-15-4-5-16(18(26)10-22)21(15,11-23)9-17(25)19(14)20/h8,11,14-17,19,22,25H,2-7,9-10H2,1H3
C21H28O5360.444121100
12345

Advertisement