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
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Found 893 results

Search term: C29H40N2O4 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9802

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C29H40N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3/t18-,21-,24+,25-/m0/s1
C29H40N2O4480.6389649531140372
8823777

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C29H40N2O4/c1-5-34-27-19-22(14-15-24(27)29(33)35-6-2)20-28(32)30-25(18-21(3)4)23-12-8-9-13-26(23)31-16-10-7-11-17-31/h8-9,12-15,19,21,25H,5-7,10-11,16-18,20H2,1-4H3,(H,30,32)/t25-/m0/s1
C29H40N2O4480.6389605100
13639394

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C29H40N2O4/c1-5-34-27-19-22(14-15-24(27)29(33)35-6-2)20-28(32)30-25(18-21(3)4)23-12-8-9-13-26(23)31-16-10-7-11-17-31/h8-9,12-15,19,21,25H,5-7,10-11,16-18,20H2,1-4H3,(H,30,32)
C29H40N2O4480.6389181700
9055

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C29H40N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3
C29H40N2O4480.6389172500
9013747

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C29H40N2O4/c1-5-34-27-19-22(14-15-24(27)29(33)35-6-2)20-28(32)30-25(18-21(3)4)23-12-8-9-13-26(23)31-16-10-7-11-17-31/h8-9,12-15,19,21,25H,5-7,10-11,16-18,20H2,1-4H3,(H,30,32)/t25-/m1/s1
C29H40N2O4480.6389141300
4058392

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C29H40N2O4/c32-26-20-25(29(35-26)18-8-3-9-19-29)27(33)30-22-16-14-21(15-17-22)28(34)31(23-10-4-1-5-11-23)24-12-6-2-7-13-24/h14-17,23-25H,1-13,18-20H2,(H,30,33)
C29H40N2O4480.638913900
2437925
InChI=1/C29H40N2O4/c1-6-34-25-19-24(31-28(33)21-13-15-22(16-14-21)29(3,4)5)26(35-7-2)18-23(25)30-27(32)17-20-11-9-8-10-12-20/h13-16,18-20H,6-12,17H2,1-5H3,(H,30,32)(H,31,33)
C29H40N2O4480.638911600
17480779
InChI=1/C29H40N2O4/c1-18-21-13-19-9-12-29(10-7-6-8-11-29)35-23(19)15-24(21)34-26(33)22(18)14-25(32)30-20-16-27(2,3)31-28(4,5)17-20/h13,15,20,31H,6-12,14,16-17H2,1-5H3,(H,30,32)
C29H40N2O4480.638911900
144336

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C29H40N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3/t18-,21-,24-,25-/m0/s1
C29H40N2O4480.6389101002
976495

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C29H40N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3/t18-,21-,24+,25-/m1/s1
C29H40N2O4480.638910800
17339560

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C29H40N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3/t18-,21-,24+,25?/m0/s1
C29H40N2O4480.63898800
21988184
InChI=1/C29H40N2O4/c1-28(2,3)21-17-19(18-22(26(21)34)29(4,5)6)11-12-25(33)31-15-13-20(14-16-31)27(35)30-23-9-7-8-10-24(23)32/h7-10,17-18,20,32,34H,11-16H2,1-6H3,(H,30,35)
C29H40N2O4480.63898500
22859240

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C29H40N2O4/c1-6-26(32)30-27-23-9-7-8-10-24(23)29(28(27)35-18-17-33-4)13-15-31(16-14-29)19-22-11-12-25(34-5)21(3)20(22)2/h7-12,27-28H,6,13-19H2,1-5H3,(H,30,32)/t27-,28+/m1/s1
C29H40N2O4480.63898800
29655473

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C29H40N2O4/c1-4-5-13-30-29(32)25-14-22(20-35-26-11-10-23-7-6-8-24(23)16-26)18-31(19-25)17-21-9-12-27(33-2)28(15-21)34-3/h9-12,15-16,22,25H,4-8,13-14,17-20H2,1-3H3,(H,30,32)/t22-,25+/m0/s1
C29H40N2O4480.63898800
29655981

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C29H40N2O4/c1-20(2)15-30-29(32)25-12-22(19-35-26-10-9-23-6-5-7-24(23)14-26)17-31(18-25)16-21-8-11-27(33-3)28(13-21)34-4/h8-11,13-14,20,22,25H,5-7,12,15-19H2,1-4H3,(H,30,32)/t22-,25+/m0/s1
C29H40N2O4480.63898800
8046921

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C29H40N2O4/c1-21(2)20-35-27(33)17-30-28(34)24(15-23-9-6-5-7-10-23)19-31-14-13-29(4,22(3)18-31)25-11-8-12-26(32)16-25/h5-12,16,21-22,24,32H,13-15,17-20H2,1-4H3,(H,30,34)/t22-,24-,29+/m0/s1
C29H40N2O4480.63898400
23072569

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C29H40N2O4/c1-22-19-31(20-23-10-11-25(33-4)18-26(23)35-22)16-12-27(32)30-15-13-29(24-8-6-5-7-9-24)14-17-34-28(2,3)21-29/h5-11,18,22H,12-17,19-21H2,1-4H3,(H,30,32)
C29H40N2O4480.63897700
21384082

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C29H40N2O4/c1-20-17-28(35-16-13-31-11-14-34-15-12-31)22(3)27-18-24(7-10-26(20)27)21(2)29(32)30-19-23-5-8-25(33-4)9-6-23/h5-6,8-9,17,21,24H,7,10-16,18-19H2,1-4H3,(H,30,32)/t21-,24+/m0/s1
C29H40N2O4480.63897500
4161685
InChI=1/C29H40N2O4/c1-22(2)14-20-34-26-10-6-24(7-11-26)28(32)30-16-5-17-31(19-18-30)29(33)25-8-12-27(13-9-25)35-21-15-23(3)4/h6-13,22-23H,5,14-21H2,1-4H3
C29H40N2O4480.63897400
4161692

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C29H40N2O4/c1-20(2)24-8-12-26(13-9-24)34-22(5)28(32)30-16-7-17-31(19-18-30)29(33)23(6)35-27-14-10-25(11-15-27)21(3)4/h8-15,20-23H,7,16-19H2,1-6H3
C29H40N2O4480.63897400
12345

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