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 190 results

Search term: C16H28N4O6 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
134569

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C16H28N4O6/c1-9(14(23)19-10(2)16(25)26)18-15(24)13(20-12(4)22)7-5-6-8-17-11(3)21/h9-10,13H,5-8H2,1-4H3,(H,17,21)(H,18,24)(H,19,23)(H,20,22)(H,25,26)/t9-,10-,13+/m1/s1
C16H28N4O6372.4167252900
6004760

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H28N4O6/c1-9(2)11(13(21)22)17-15(25)19-5-7-20(8-6-19)16(26)18-12(10(3)4)14(23)24/h9-12H,5-8H2,1-4H3,(H,17,25)(H,18,26)(H,21,22)(H,23,24)/t11-,12-/m0/s1
C16H28N4O6372.416715900
10039984

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H28N4O6/c17-12(22)8-18-14(24)16(26)6-10(13(23)11(21)7-16)20-15(25)19-9-4-2-1-3-5-9/h9-11,13,21,23,26H,1-8H2,(H2,17,22)(H,18,24)(H2,19,20,25)/t10-,11+,13+,16-/m0/s1
C16H28N4O6372.416710700
32702166

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C16H28N4O6/c1-2-3-4-5-6-7-25-16(24)19-14-17-10-20(15(23)18-14)13-8-11(22)12(9-21)26-13/h11-13,21-22H,2-10H2,1H3,(H2,17,18,19,23,24)/t11-,12+,13+/m0/s1
C16H28N4O6372.4167101100
5977733

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H28N4O6/c1-10(2)17-16(24)19-6-7-20(13(21)9-25-4)12(8-19)14(22)18-11(3)15(23)26-5/h10-12H,6-9H2,1-5H3,(H,17,24)(H,18,22)/t11-,12+/m1/s1
C16H28N4O6372.416710700
296524
InChI=1/C14H26N4O2.C2H2O4/c1-3-15(4-2)9-10-16-11-13(19)17-7-5-6-8-18(17)14(20)12-16;3-1(4)2(5)6/h3-12H2,1-2H3;(H,3,4)(H,5,6)
C16H28N4O6372.416729800
17588236
InChI=1/C16H28N4O6/c21-13-5-7-16(24)20(26)12-4-2-10-18-14(22)6-8-15(23)19(25)11-3-1-9-17-13/h25-26H,1-12H2,(H,17,21)(H,18,22)
C16H28N4O6372.416781000
77450307

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H28N4O6/c1-15(2,3)26-14(24)18-11(12(21)22)7-5-6-9-17-13(23)25-10-8-16(4)19-20-16/h11H,5-10H2,1-4H3,(H,17,23)(H,18,24)(H,21,22)/t11-/m0/s1
C16H28N4O6372.41677600
389000

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C16H28N4O6/c1-9(14(23)19-10(2)16(25)26)18-15(24)13(20-12(4)22)7-5-6-8-17-11(3)21/h9-10,13H,5-8H2,1-4H3,(H,17,21)(H,18,24)(H,19,23)(H,20,22)(H,25,26)/t9-,10-,13-/m0/s1
C16H28N4O6372.41676500
3814318

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H28N4O6/c1-19(9-13(21)22)15(25)17-7-11-4-3-5-12(6-11)8-18-16(26)20(2)10-14(23)24/h11-12H,3-10H2,1-2H3,(H,17,25)(H,18,26)(H,21,22)(H,23,24)
C16H28N4O6372.41676400
5731073

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C16H28N4O6/c1-9(14(23)19-10(2)16(25)26)18-15(24)13(20-12(4)22)7-5-6-8-17-11(3)21/h9-10,13H,5-8H2,1-4H3,(H,17,21)(H,18,24)(H,19,23)(H,20,22)(H,25,26)/t9-,10+,13-/m0/s1
C16H28N4O6372.41676500
3566719

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C16H28N4O6/c1-9(14(23)19-10(2)16(25)26)18-15(24)13(20-12(4)22)7-5-6-8-17-11(3)21/h9-10,13H,5-8H2,1-4H3,(H,17,21)(H,18,24)(H,19,23)(H,20,22)(H,25,26)
C16H28N4O6372.416725300
4589473

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C16H28N4O6/c1-5-17-9(2)14(24)20-16(26)11(4)19-15(25)10(3)18-12(21)7-6-8-13(22)23/h9-11,17H,5-8H2,1-4H3,(H,18,21)(H,19,25)(H,22,23)(H,20,24,26)/t9-,10-,11-/m0/s1
C16H28N4O6372.41674400
5731227

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H28N4O6/c1-3-9(2)13(15(24)18-10(8-21)16(25)26)19-14(23)11-5-4-6-20(11)12(22)7-17/h9-11,13,21H,3-8,17H2,1-2H3,(H,18,24)(H,19,23)(H,25,26)/t9-,10-,11-,13-/m0/s1
C16H28N4O6372.41673300
23267357

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C16H28N4O6/c17-8-2-1-4-10(18)15(24)20-9-3-5-12(20)14(23)19-11(16(25)26)6-7-13(21)22/h10-12H,1-9,17-18H2,(H,19,23)(H,21,22)(H,25,26)/t10-,11-,12-/m0/s1
C16H28N4O6372.41673301
28495777

Double-bond stereo
InChI=1/C12H24N4O2.C4H4O4/c17-11-13-3-1-5-15-7-9-16(10-8-15)6-2-4-14-12-18;5-3(6)1-2-4(7)8/h11-12H,1-10H2,(H,13,17)(H,14,18);1-2H,(H,5,6)(H,7,8)/b;2-1+
C16H28N4O6372.41673300
10175489

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H28N4O6/c1-6-12(20(23)24)13(14(21)19-7-9-25-10-8-19)11(2)17-18-15(22)26-16(3,4)5/h12-13H,6-10H2,1-5H3,(H,18,22)/b17-11+
C16H28N4O6372.41673200
13164838

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H28N4O6/c1-8(2)12(20-13(22)10-5-4-6-17-10)15(24)19-11(7-21)14(23)18-9(3)16(25)26/h8-12,17,21H,4-7H2,1-3H3,(H,18,23)(H,19,24)(H,20,22)(H,25,26)/t9-,10-,11-,12-/m0/s1
C16H28N4O6372.41673300
16572904

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C16H28N4O6/c17-8-2-1-4-10(18)15(24)20-9-3-5-12(20)14(23)19-11(16(25)26)6-7-13(21)22/h10-12H,1-9,17-18H2,(H,19,23)(H,21,22)(H,25,26)
C16H28N4O6372.4167321510
16661590

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C16H28N4O6/c1-9(2)6-10(17)15(24)20-5-3-4-12(20)14(23)18-7-13(22)19-11(8-21)16(25)26/h9-12,21H,3-8,17H2,1-2H3,(H,18,23)(H,19,22)(H,25,26)
C16H28N4O6372.41673206
12345

Advertisement