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 58 results

Search term: C20H31NO8 (Found by molecular formula)
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
23268828

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H31NO8/c22-15(14-17(23)21-16-11-13-29-20(16)27)8-6-4-2-1-3-5-7-12-28-19(26)10-9-18(24)25/h16H,1-14H2,(H,21,23)(H,24,25)/t16-/m0/s1
C20H31NO8413.462372300
2197734
InChI=1/C18H29NO4.C2H2O4/c1-4-6-16-15-17(21-3)7-8-18(16)23-14-13-22-12-10-19-9-5-11-20-2;3-1(4)2(5)6/h4,7-8,15,19H,1,5-6,9-14H2,2-3H3;(H,3,4)(H,5,6)
C20H31NO8413.462049800
2209293

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C18H29NO4.C2H2O4/c1-4-21-17-5-7-18(8-6-17)22-12-11-20-10-9-19-13-15(2)23-16(3)14-19;3-1(4)2(5)6/h5-8,15-16H,4,9-14H2,1-3H3;(H,3,4)(H,5,6)
C20H31NO8413.462048800
10912103

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C18H29NO4.C2H2O4/c1-2-22-17-6-8-18(9-7-17)23-14-16(21)13-19-11-4-3-5-15(19)10-12-20;3-1(4)2(5)6/h6-9,15-16,20-21H,2-5,10-14H2,1H3;(H,3,4)(H,5,6)
C20H31NO8413.4628700
10933813

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C18H29NO4.C2H2O4/c1-13(2)8-9-14(3)19-11-16(20)12-23-17-7-5-6-15(10-17)18(21)22-4;3-1(4)2(5)6/h5-7,10,13-14,16,19-20H,8-9,11-12H2,1-4H3;(H,3,4)(H,5,6)
C20H31NO8413.4628700
10942962

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C18H29NO4.C2H2O4/c1-14-5-4-8-19(10-14)11-16(20)13-23-12-15-6-7-17(21-2)18(9-15)22-3;3-1(4)2(5)6/h6-7,9,14,16,20H,4-5,8,10-13H2,1-3H3;(H,3,4)(H,5,6)
C20H31NO8413.4628700
26559114

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H31NO8/c22-15(14-17(23)21-16-11-13-29-20(16)27)8-6-4-2-1-3-5-7-12-28-19(26)10-9-18(24)25/h16H,1-14H2,(H,21,23)(H,24,25)
C20H31NO8413.4627600
2208450

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C18H29NO4.C2H2O4/c1-14-5-6-17(18(11-14)20-4)22-10-9-21-8-7-19-12-15(2)23-16(3)13-19;3-1(4)2(5)6/h5-6,11,15-16H,7-10,12-13H2,1-4H3;(H,3,4)(H,5,6)
C20H31NO8413.462047700
31146616

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C20H31NO8/c1-6-12(2)17(23)29-15-8-10-21(27)9-7-14(16(15)21)11-28-18(24)20(26,13(3)22)19(4,5)25/h6-7,13,15-16,22,25-26H,8-11H2,1-5H3/b12-6-/t13-,15+,16+,20-,21?/m0/s1
C20H31NO8413.4625400
68911768

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C20H31NO8/c1-6-12(2)17(23)29-15-8-10-21(27)9-7-14(16(15)21)11-28-18(24)20(26,13(3)22)19(4,5)25/h6-7,13,15-16,22,25-26H,8-11H2,1-5H3/b12-6-/t13-,15+,16+,20?,21?/m0/s1
C20H31NO8413.4624400
2343407
InChI=1/C14H23NO.C6H8O7/c1-4-15(5-2)12-8-10-13-9-6-7-11-14(13)16-3;7-3(8)1-6(13,5(11)12)2-4(9)10/h6-7,9,11H,4-5,8,10,12H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
C20H31NO8413.462044400
9157751

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C20H31NO8/c1-12(8-17(26-4)19(28-6)13(2)11-22)18(27-5)15-9-14(25-3)10-16(21(23)24)20(15)29-7/h9-13,17-19H,8H2,1-7H3/t12-,13-,17-,18+,19+/m0/s1
C20H31NO8413.4623200
9308540

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C20H31NO8/c1-18(2,3)29-17(24)21-11(8-9-13(21)22)14(23)16-15(27-20(6,7)28-16)12-10-25-19(4,5)26-12/h8-9,11-12,14-16,23H,10H2,1-7H3/t11-,12+,14+,15+,16+/m0/s1
C20H31NO8413.4623200
115009285

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C20H31NO8/c1-6-12(2)17(23)29-15-8-10-21(27)9-7-14(16(15)21)11-28-18(24)20(26,13(3)22)19(4,5)25/h6-7,13,15-16,22,25-26H,8-11H2,1-5H3/b12-6-/t13-,15-,16+,20+,21?/m0/s1
C20H31NO8413.4623300
23196892

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C20H31NO8/c1-19(2)26-15-14(25-18-17(16(15)27-19)28-20(3,4)29-18)11-23-10-12(22)8-21-9-13-6-5-7-24-13/h5-7,12,14-18,21-22H,8-11H2,1-4H3/t12?,14?,15-,16-,17+,18+/m0/s1
C20H31NO8413.4623300
9829270

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H31NO8/c1-7-26-17(23)14-11-10-13(21(14)12-15(22)29-20(4,5)6)16(18(24)27-8-2)19(25)28-9-3/h14H,7-12H2,1-6H3/t14-/m0/s1
C20H31NO8413.4623200
9904067

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C20H31NO8/c22-14(23)11-21-18(25)17-16(28-20(29-17)9-5-2-6-10-20)15(24)13-12-26-19(27-13)7-3-1-4-8-19/h13,15-17,24H,1-12H2,(H,21,25)(H,22,23)/t13-,15-,16+,17+/m1/s1
C20H31NO8413.4622100
9593401

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C20H31NO8/c1-23-12-27-18-15(9-17(22)25-3)29-16(10-21)19(28-13-24-2)20(18)26-11-14-7-5-4-6-8-14/h4-8,15-16,18-20H,9-13,21H2,1-3H3/t15-,16-,18+,19-,20-/m1/s1
C20H31NO8413.4622100
9168541
InChI=1/C20H31NO8/c1-19(2)20(3,4)29-12-8-10-27-16-14(18(23)25-6)21-13(17(22)24-5)15(16)26-9-7-11-28-19/h21H,7-12H2,1-6H3
C20H31NO8413.4622100
8245865

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C20H31NO8/c1-12(8-16-17(25-5)11-28-20(2,3)29-16)18(26-6)14-9-13(24-4)10-15(21(22)23)19(14)27-7/h9-10,12,16-18H,8,11H2,1-7H3/t12-,16+,17+,18+/m0/s1
C20H31NO8413.4622100
123

Advertisement