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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
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Found 48 results

Search term: C27H18O5 (Found by molecular formula)
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
1274417
InChI=1/C27H18O5/c1-17-6-2-5-9-22(17)27(29)32-21-12-13-23-24(15-21)30-16-25(26(23)28)31-20-11-10-18-7-3-4-8-19(18)14-20/h2-16H,1H3
C27H18O5422.4288191000
1274418
InChI=1/C27H18O5/c1-17-5-4-8-20(13-17)27(29)32-22-11-12-23-24(15-22)30-16-25(26(23)28)31-21-10-9-18-6-2-3-7-19(18)14-21/h2-16H,1H3
C27H18O5422.4288191000
1274419
InChI=1/C27H18O5/c1-17-6-8-19(9-7-17)27(29)32-22-12-13-23-24(15-22)30-16-25(26(23)28)31-21-11-10-18-4-2-3-5-20(18)14-21/h2-16H,1H3
C27H18O5422.4288191000
1345119
InChI=1/C27H18O5/c28-24-20-14-7-8-15-21(20)31-25(22-16-9-17-30-22)26(24)32-27(29)23(18-10-3-1-4-11-18)19-12-5-2-6-13-19/h1-17,23H
C27H18O5422.4288191200
2346684
InChI=1/C27H18O5/c28-25(19-11-15-23(16-12-19)31-26(29)21-7-3-1-4-8-21)20-13-17-24(18-14-20)32-27(30)22-9-5-2-6-10-22/h1-18H
C27H18O5422.42882191200
2225987

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C27H18O5/c1-26(23(28)17-9-3-2-4-10-17)22-21-18-11-6-5-8-16(18)13-14-19(21)32-25(30)27(22,26)24(29)20-12-7-15-31-20/h2-15,22H,1H3
C27H18O5422.42882161400
20307426
InChI=1/C27H18O5/c1-15-26-21(22(14-30-26)24-11-17-5-3-4-6-23(17)31-24)12-20-19(13-25(28)32-27(15)20)16-7-9-18(29-2)10-8-16/h3-14H,1-2H3
C27H18O5422.4288151100
1401370

Double-bond stereo
InChI=1/C27H18O5/c28-26-17-22(23-15-19-10-4-5-11-24(19)32-27(23)29)21-13-12-20(16-25(21)31-26)30-14-6-9-18-7-2-1-3-8-18/h1-13,15-17H,14H2/b9-6+
C27H18O5422.428813800
35147223

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H18O5/c28-24-13-20(18-12-17-8-4-5-9-22(17)30-14-18)25-23(32-24)11-10-19-26(29)21(15-31-27(19)25)16-6-2-1-3-7-16/h1-12,15,20H,13-14H2
C27H18O5422.42887600
35145535

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H18O5/c28-24-14-20(18-13-17-8-4-5-9-21(17)30-15-18)25-22(31-24)11-10-19-26(29)23(32-27(19)25)12-16-6-2-1-3-7-16/h1-13,20H,14-15H2/b23-12-
C27H18O5422.42886500
471391

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C27H18O5/c1-16(28)31-27-21-14-8-7-13-20(21)25(30)26(27,17-9-3-2-4-10-17)22-15-23(29)18-11-5-6-12-19(18)24(22)32-27/h2-15,29H,1H3
C27H18O5422.42885500
547205
InChI=1/C27H18O5/c28-25(19-11-15-21(16-12-19)26(29)31-23-7-3-1-4-8-23)20-13-17-22(18-14-20)27(30)32-24-9-5-2-6-10-24/h1-18H
C27H18O5422.42885500
23185449
InChI=1/C27H18O5/c28-18-9-10-21-23(15-18)32-27(25(21)20-7-3-5-16-4-1-2-6-19(16)20)26(29)17-8-11-22-24(14-17)31-13-12-30-22/h1-11,14-15,28H,12-13H2
C27H18O5422.42884400
28691788
InChI=1/C27H18O5/c28-25(19-10-4-1-5-11-19)24-18-20(26(29)31-21-12-6-2-7-13-21)16-17-23(24)27(30)32-22-14-8-3-9-15-22/h1-18H
C27H18O5422.42884300
8701632
InChI=1/C27H18O5/c28-24-15-25(32-26-22(24)6-3-7-23(26)27(29)30)19-10-12-21(13-11-19)31-16-17-8-9-18-4-1-2-5-20(18)14-17/h1-15H,16H2,(H,29,30)
C27H18O5422.42884300
4020047

Double-bond stereo
InChI=1/C27H18O5/c28-26-17-22(23-15-19-10-4-5-11-24(19)32-27(23)29)21-13-12-20(16-25(21)31-26)30-14-6-9-18-7-2-1-3-8-18/h1-13,15-17H,14H2
C27H18O5422.428823200
1349399
InChI=1/C27H18O5/c28-22-17-25(24-12-7-15-30-24)32-23-14-13-20(16-21(22)23)31-27(29)26(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-17,26H
C27H18O5422.42883200
1350574
InChI=1/C27H18O5/c1-17-6-4-9-19(14-17)31-25-16-30-24-15-20(12-13-23(24)26(25)28)32-27(29)22-11-5-8-18-7-2-3-10-21(18)22/h2-16H,1H3
C27H18O5422.42883200
1350575
InChI=1/C27H18O5/c1-17-9-11-19(12-10-17)31-25-16-30-24-15-20(13-14-23(24)26(25)28)32-27(29)22-8-4-6-18-5-2-3-7-21(18)22/h2-16H,1H3
C27H18O5422.42883200
1361053
InChI=1/C27H18O5/c28-22(20-14-12-19(13-15-20)18-7-2-1-3-8-18)17-31-27-25(29)21-9-4-5-10-23(21)32-26(27)24-11-6-16-30-24/h1-16H,17H2
C27H18O5422.42883200
123

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