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 6 results

Search term: ANWUQYTXRXCEMZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
388735

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C35H36N4O5.Mg/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22;/h8,12-14,17,21,31H,1,9-11H2,2-7H3,(H3,36,37,38,39,40,41,42);/q;+2/p-2/t17-,21-,31+;/m0./s1
C35H34MgN4O5614.9732599999994700
146273

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C35H36N4O5.Mg/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22;/h8,12-14,17,21,31H,1,9-11H2,2-7H3,(H3,36,37,38,39,40,41,42);/q;+2/p-2
C35H34MgN4O5614.973259999999313400
3823260

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C35H36N4O5.Mg/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22;/h8,12-14,17,21,31H,1,9-11H2,2-7H3,(H3,36,37,38,39,40,41,42);/q;+2
C35H36MgN4O5616.9881100
24785210

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C35H36N4O5.Mg/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22;/h8,12-14,17,21,31H,1,9-11H2,2-7H3,(H3,36,37,38,39,40,41,42);/q;+2/p-3/rC35H34MgN4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(41)42)32-30-31(35(44)45-7)34(43)29-18(6)25-14-27-20(9-2)16(4)23-13-26(19)37(22)36(38(23)27,39(24)32)40(25)33(29)30/h8,12-14,17,21,31H,1,9-11H2,2-7H3,(H,41,42)/p-1
C35H33MgN4O5613.965321500
34999242

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C35H36N4O5.Mg/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22;/h8,12-14,17,21,31H,1,9-11H2,2-7H3,(H3,36,37,38,39,40,41,42);/q;+2/p-2/t17-,21-,31+;/m0./s1/rC35H34MgN4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(41)42)32-30-31(35(44)45-7)34(43)29-18(6)25-14-27-20(9-2)16(4)23-13-26(19)37(22)36(38(23)27,39(24)32)40(25)33(29)30/h8,12-14,17,21,31H,1,9-11H2,2-7H3,(H,41,42)/t17-,21-,31+/m0/s1
C35H34MgN4O5614.97331100
34999246

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C35H36N4O5.Mg/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22;/h8,12-14,17,21,31H,1,9-11H2,2-7H3,(H3,36,37,38,39,40,41,42);/q;+2/p-3/t17-,21-,31+;/m0./s1/rC35H34MgN4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(41)42)32-30-31(35(44)45-7)34(43)29-18(6)25-14-27-20(9-2)16(4)23-13-26(19)37(22)36(38(23)27,39(24)32)40(25)33(29)30/h8,12-14,17,21,31H,1,9-11H2,2-7H3,(H,41,42)/p-1/t17-,21-,31+/m0/s1
C35H33MgN4O5613.96591100

Advertisement