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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
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Found 160 results

Search term: C29H41NO4 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
559124


7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3/t20-,21-,24-,26+,27-,28+,29-/m1/s1
C29H41NO4467.640152100338752
2213300

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C29H41NO4/c1-6-28(31)30(21-23-12-13-26(32-4)27(19-23)33-5)16-14-24(18-22-10-8-7-9-11-22)25-15-17-34-29(2,3)20-25/h7-13,19,24-25H,6,14-18,20-21H2,1-5H3
C29H41NO4467.64014181300
3807200

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C29H41NO4/c1-21(2)28-19-29(16-18-33-28,26-9-7-8-10-27(26)32-6)15-17-30(23(5)31)20-24-11-13-25(14-12-24)34-22(3)4/h7-14,21-22,28H,15-20H2,1-6H3
C29H41NO4467.64014151000
2297556

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C29H41NO4/c1-15-12-23-26(30-14-15)17(3)29(34-23)11-9-21-22-7-6-19-13-20(33-18(4)31)8-10-28(19,5)25(22)27(32)24(21)16(29)2/h6,15,17,20-23,25-26,30H,7-14H2,1-5H3/t15-,17+,20-,21-,22-,23+,25+,26-,28-,29-/m0/s1
C29H41NO4467.6401141500
2382

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3
C29H41NO4467.640111194900
21540380

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C29H41NO4/c1-4-6-7-8-9-10-11-12-19-33-27-18-15-25(28(31)20-27)21-30-26-16-13-24(14-17-26)29(32)34-22-23(3)5-2/h13-18,20-21,23,31H,4-12,19,22H2,1-3H3/b30-21+
C29H41NO4467.640110800
32699584

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H41NO4/c1-7-8-14-30-15-13-28-22-18-9-10-19(31)23(22)34-24(28)29(33-6)12-11-27(28,21(30)16-18)17-20(29)26(5,32)25(2,3)4/h7,9-10,20-21,24,31-32H,1,8,11-17H2,2-6H3/t20-,21-,24-,26+,27-,28+,29-/m1/s1
C29H41NO4467.640191000
21774768
InChI=1/C29H41NO4/c1-7-13-30(14-8-2)20-11-9-19(10-12-20)25(26-21(31)15-28(3,4)16-22(26)32)27-23(33)17-29(5,6)18-24(27)34/h9-12,25-27H,7-8,13-18H2,1-6H3
C29H41NO4467.64017500
4444543

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3/t20-,21-,24-,26?,27-,28+,29-/m1/s1
C29H41NO4467.6401471000
2530449
InChI=1/C29H41NO4/c1-7-13-30(14-8-2)20-11-9-19(10-12-20)25(26-21(31)15-28(3,4)16-22(26)32)27-23(33)17-29(5,6)18-24(27)34/h9-12,25,31,33H,7-8,13-18H2,1-6H3
C29H41NO4467.64016400
2287961
InChI=1/C29H41NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-24-19-17-20-25(23-24)33-28(31)26-21-15-16-22-27(26)34-29(30)32/h15-17,19-23H,2-14,18H2,1H3,(H2,30,32)
C29H41NO4467.640146700
8024703

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3/t20-,21-,24-,26+,27-,28+,29+/m1/s1
C29H41NO4467.64016400
57394478

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C29H41NO4/c1-25(2)28(7)13-14-29(25,17-23(28)24(31)34-27(5,6)26(3,4)32)21-11-8-10-20(16-21)18-30-19-22-12-9-15-33-22/h8-12,15-16,23,30,32H,13-14,17-19H2,1-7H3
C29H41NO4467.64015600
7987538

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3/t20-,21-,24-,26-,27-,28+,29+/m1/s1
C29H41NO4467.64015600
146630

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C29H41NO4/c1-15-12-23-26(30(14-15)18(4)31)17(3)29(34-23)11-9-21-22-7-6-19-13-20(32)8-10-28(19,5)25(22)27(33)24(21)16(29)2/h6,15,17,20-23,25-26,32H,7-14H2,1-5H3/t15-,17+,20-,21-,22-,23+,25+,26-,28-,29-/m0/s1
C29H41NO4467.64014400
68390059
InChI=1/C29H41NO4/c1-23-7-12-27(24(2)19-23)34-22-29(32-3)15-17-30(18-16-29)20-25-8-10-26(11-9-25)33-21-28(31)13-5-4-6-14-28/h7-12,19,31H,4-6,13-18,20-22H2,1-3H3
C29H41NO4467.64014300
68658603

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C29H41NO4/c1-24-7-11-26(12-8-24)34-23-29(32-2)17-6-19-30(20-18-29)21-25-9-13-27(14-10-25)33-22-28(31)15-4-3-5-16-28/h7-14,31H,3-6,15-23H2,1-2H3
C29H41NO4467.64014300
68717662

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C29H41NO4/c1-23-7-12-27(24(2)19-23)34-22-29(32)15-6-17-30(18-16-29)20-25-8-10-26(11-9-25)33-21-28(31)13-4-3-5-14-28/h7-12,19,31-32H,3-6,13-18,20-22H2,1-2H3
C29H41NO4467.64014300
9147898

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C29H41NO4/c1-7-27(3,33)18-19-28(4)20(2)15-16-23-22(28)14-11-17-29(23,5)26(32)30-24(25(31)34-6)21-12-9-8-10-13-21/h7-10,12-14,20,23-24,33H,1,11,15-19H2,2-6H3,(H,30,32)/t20-,23+,24-,27+,28+,29+/m1/s1
C29H41NO4467.64014300
9202210

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C29H41NO4/c1-7-27(3,33)18-19-28(4)20(2)15-16-23-22(28)14-11-17-29(23,5)26(32)30-24(25(31)34-6)21-12-9-8-10-13-21/h7-10,12-14,20,23-24,33H,1,11,15-19H2,2-6H3,(H,30,32)/t20-,23+,24+,27+,28+,29+/m1/s1
C29H41NO4467.64014300
12345

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