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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
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 8 results

Search term: FUTVBRXUIKZACV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
388965

Charge

Double-bond stereo
InChI=1/C34H34N4O4.Zn/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;
C34H32N4O4Zn626.0222799999992146800
29305007

Charge

Double-bond stereo
InChI=1/C34H34N4O4.Zn/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;/rC34H32N4O4Zn/c1-7-21-17(3)25-13-29-20(6)24(10-12-34(41)42)32-16-28-23(9-11-33(39)40)18(4)26(36-28)14-31-22(8-2)19(5)30(15-27(21)35-25)37(31)43-38(29)32/h7-8,13-16H,1-2,9-12H2,3-6H3,(H,39,40)(H,41,42)/b25-13-,26-14-,27-15-,28-16-,29-13-,30-15-,31-14-,32-16-
C34H32N4O4Zn626.0513182800
21171167

Charge

Double-bond stereo
InChI=1/C34H34N4O4.Zn/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;/rC34H32N4O4Zn/c1-7-21-17(3)26-14-31-22(8-2)19(5)29-13-25-18(4)23(9-11-33(39)40)28(36-25)16-32-24(10-12-34(41)42)20(6)30(15-27(21)35-26)38(32)43-37(29)31/h7-8,13-16H,1-2,9-12H2,3-6H3,(H,39,40)(H,41,42)/b25-13-,26-14-,27-15-,28-16-,29-13-,30-15-,31-14-,32-16-
C34H32N4O4Zn626.05138600
25396

Charge

Double-bond stereo
InChI=1/C34H34N4O4.Zn/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-4/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;
C34H30N4O4Zn624.006399999999411200
28467492

Charge

Double-bond stereo
InChI=1/C34H34N4O4.Zn/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2/b25-13-,26-13-,27-14+,28-15-,29-14-,30-15+,31-16-,32-16-;/rC34H32N4O4Zn/c1-7-21-17(3)26-14-31-22(8-2)19(5)29-13-25-18(4)23(9-11-33(39)40)28(36-25)16-32-24(10-12-34(41)42)20(6)30(15-27(21)35-26)38(32)43-37(29)31/h7-8,13-16H,1-2,9-12H2,3-6H3,(H,39,40)(H,41,42)/b25-13-,26-14+,27-15+,28-16-,29-13-,30-15-,31-14-,32-16-
C34H32N4O4Zn626.05134500
21241487

Charge

Double-bond stereo
InChI=1/C34H34N4O4.Zn/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;/rC34H32N4O4Zn/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31-16-32-24(10-12-34(41)42)20(6)28-15-30-22(8-2)18(4)27-14-29(21)35(25)43(36(27)30,37(26)31)38(28)32/h7-8,13-16H,1-2,9-12H2,3-6H3,(H,39,40)(H,41,42)
C34H32N4O4Zn626.022282100
76826986

Charge

Double-bond stereo
InChI=1/C34H34N4O4.Zn/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15+,31-16+,32-16?;/rC34H32N4O4Zn/c1-7-21-17(3)26-14-31-22(8-2)19(5)29-13-25-18(4)23(9-11-33(39)40)28(36-25)16-32-24(10-12-34(41)42)20(6)30(15-27(21)35-26)38(32)43-37(29)31/h7-8,13-16H,1-2,9-12H2,3-6H3,(H,39,40)(H,41,42)/b25-13-,26-14-,27-15+,28-16+,29-13-,30-15-,31-14-,32-16?
C34H32N4O4Zn626.05131100

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