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 22 results

Search term: C40H50O2 (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4444663

Double-bond stereo
InChI=1/C40H50O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26H,27-28H2,1-10H3/b15-11+,16-12+,19-13+,20-14+,29-17+,30-18+,31-21+,32-22+,37-23-,38-24-
C40H50O2562.823826291461
4528470

Double-bond stereo
InChI=1/C40H50O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26H,27-28H2,1-10H3/b15-11+,16-12+,19-13+,20-14+,29-17+,30-18+,31-21+,32-22+,37-23+,38-24+
C40H50O2562.82386700
10478586

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C40H50O2/c1-28(17-13-19-30(3)21-25-36-33(6)24-23-32(5)34(36)7)15-11-12-16-29(2)18-14-20-31(4)22-26-37-35(8)39(42)38(41)27-40(37,9)10/h11-26,38,41H,27H2,1-10H3/b12-11+,17-13+,18-14+,25-21+,26-22+,28-15+,29-16+,30-19+,31-20+/t38-/m0/s1
C40H50O2562.82384400
9083115

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C40H50O2/c1-35(2)31-17-19-37(35,5)33(39(31)23-27-13-7-8-14-28(27)24-39)41-21-11-12-22-42-34-38(6)20-18-32(36(38,3)4)40(34)25-29-15-9-10-16-30(29)26-40/h7-16,21-22,31-34H,17-20,23-26H2,1-6H3/b21-11+,22-12+/t31-,32-,33-,34-,37-,38-/m0/s1
C40H50O2562.82383200
9679845
InChI=1/C40H50O2/c1-9-11-23-33-31-35(39(3,4)5)25-27-37(33)41-29-21-19-17-15-13-14-16-18-20-22-30-42-38-28-26-36(40(6,7)8)32-34(38)24-12-10-2/h1-2,25-28,31-32H,13-22,29-30H2,3-8H3
C40H50O2562.82383200
83719

Double-bond stereo
InChI=1/C40H50O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26H,27-28H2,1-10H3
C40H50O2562.82383200
10470122

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C40H50O2/c1-28(17-13-19-30(3)21-24-36-25-23-32(5)33(6)34(36)7)15-11-12-16-29(2)18-14-20-31(4)22-26-37-35(8)39(42)38(41)27-40(37,9)10/h11-26,38,41H,27H2,1-10H3/b12-11+,17-13+,18-14+,24-21+,26-22+,28-15+,29-16+,30-19+,31-20+
C40H50O2562.82382200
10475792

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C40H50O2/c1-28(17-13-19-30(3)21-25-36-33(6)24-23-32(5)34(36)7)15-11-12-16-29(2)18-14-20-31(4)22-26-37-35(8)39(42)38(41)27-40(37,9)10/h11-26,38,41H,27H2,1-10H3/b12-11+,17-13+,18-14+,25-21+,26-22+,28-15+,29-16+,30-19+,31-20+
C40H50O2562.82382200
10478585

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C40H50O2/c1-28(17-13-19-30(3)21-24-36-25-23-32(5)33(6)34(36)7)15-11-12-16-29(2)18-14-20-31(4)22-26-37-35(8)39(42)38(41)27-40(37,9)10/h11-26,38,41H,27H2,1-10H3/b12-11+,17-13+,18-14+,24-21+,26-22+,28-15+,29-16+,30-19+,31-20+/t38-/m0/s1
C40H50O2562.82382200
9344092

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C40H50O2/c1-27(17-13-18-29(3)21-26-37-32(6)24-22-30(4)35(37)9)15-11-12-16-28(2)19-14-20-34(8)39(41)40(42)38-33(7)25-23-31(5)36(38)10/h11-26,39-42H,1-10H3/b12-11+,17-13+,19-14+,26-21+,27-15+,28-16+,29-18+,34-20+
C40H50O2562.82382100
9585327

Double-bond stereo
InChI=1/C40H50O2/c1-31(14-12-15-32(2)22-25-38-33(3)16-13-27-40(38,4)5)21-23-36-28-37(41-29-34-17-8-6-9-18-34)24-26-39(36)42-30-35-19-10-7-11-20-35/h6-11,15,17-21,24,26,28H,12-14,16,22-23,25,27,29-30H2,1-5H3/b31-21+,32-15-
C40H50O2562.82382100
4478888

Double-bond stereo
InChI=1/C40H50O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26H,27-28H2,1-10H3/b15-11+,16-12+,19-13-,20-14-,29-17-,30-18-,31-21+,32-22+,37-23+,38-24+
C40H50O2562.82382200
59700117

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C40H50O2/c1-29(18-13-20-31(3)23-24-35-33(5)22-15-26-38(35,7)8)16-11-12-17-30(2)19-14-21-32(4)25-27-40-34(6)37(41)36(42-40)28-39(40,9)10/h11-22,25,27,34,36H,26,28H2,1-10H3/b12-11+,18-13+,19-14+,27-25+,29-16+,30-17+,31-20+,32-21+/t34-,36-,40-/m0/s1
C40H50O2562.82382200
59700433

Double-bond stereo
InChI=1/C40H50O2/c1-29(17-13-19-31(3)21-25-35-33(5)23-27-37(41)39(35,7)8)15-11-12-16-30(2)18-14-20-32(4)22-26-36-34(6)24-28-38(42)40(36,9)10/h11-23,25-27H,24,28H2,1-10H3/b12-11+,17-13+,18-14+,25-21+,26-22+,29-15+,30-16+,31-19+,32-20+
C40H50O2562.82382200
95691014

Double-bond stereo
InChI=1/C40H50O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26H,27-28H2,1-10H3/b15-11+,16-12u,19-13+,20-14+,29-17u,30-18u,31-21u,32-22u,37-23+,38-24+
C40H50O2562.82381100
115295462

Double-bond stereo
InChI=1/C40H50O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26H,27-28H2,1-10H3/b15-11+,16-12u,19-13+,20-14u,29-17u,30-18+,31-21u,32-22+,37-23+,38-24u
C40H50O2562.82381100
120325705

Double-bond stereo
InChI=1/C40H50O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26H,27-28H2,1-10H3/b15-11+,16-12u,19-13+,20-14u,29-17u,30-18-,31-21u,32-22-,37-23+,38-24u
C40H50O2562.82381200
123246771

Double-bond stereo
InChI=1/C40H50O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26H,27-28H2,1-10H3/b15-11+,16-12u,19-13+,20-14u,29-17u,30-18+,31-21u,32-22+,37-23-,38-24u
C40H50O2562.82381200
30991718

Double-bond stereo
InChI=1/C40H50O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26H,27-28H2,1-10H3/b15-11+,16-12+,19-13+,20-14+,29-17-,30-18+,31-21-,32-22-,37-23+,38-24-
C40H50O2562.82381100
32697686

Double-bond stereo
InChI=1/C40H50O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26H,27-28H2,1-10H3/b15-11+,16-12+,19-13+,20-14+,29-17+,30-18+,31-21+,32-22+,37-23-,38-24+
C40H50O2562.82381100
12

Advertisement