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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 78 results

Search term: C26H28N2O9 (Found by molecular formula)
1234
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8521772

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C26H28N2O9/c1-2-11-13-7-17-19-14(20(30)12-5-3-4-6-16(12)27-19)8-28(17)24(34)15(13)10-35-25(11)37-26-23(33)22(32)21(31)18(9-29)36-26/h2-6,10-11,13,17-18,21-23,25-26,29,31-33H,1,7-9H2,(H,27,30)/t11-,13+,17+,18-,21-,22+,23-,25+,26+/m1/s1
C26H28N2O9512.5085191577
17478292
InChI=1/C26H28N2O9/c1-5-35-24(30)19(25(31)36-6-2)15-27-17-8-10-20-18(14-17)23(29)28(26(32)37-20)12-11-16-7-9-21(33-3)22(13-16)34-4/h7-10,13-15,27H,5-6,11-12H2,1-4H3
C26H28N2O9512.5085151500
3236004

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C26H28N2O9/c1-4-35-24(31)16-10-17(25(32)36-5-2)12-19(11-16)27-22(29)15-37-26(33)18-13-23(30)28(14-18)20-8-6-7-9-21(20)34-3/h6-12,18H,4-5,13-15H2,1-3H3,(H,27,29)
C26H28N2O9512.508512800
10902319
InChI=1/C26H28N2O9/c1-17(29)35-22-13-21(14-23(36-18(2)30)25(22)37-19(3)31)26(33)34-16-24(32)28-11-9-27(10-12-28)15-20-7-5-4-6-8-20/h4-8,13-14H,9-12,15-16H2,1-3H3
C26H28N2O9512.508511700
169403

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C26H28N2O9/c1-2-11-14-9-16-19-13(12-5-3-4-6-15(12)27-19)7-8-28(16)23(33)18(14)24(34)36-25(11)37-26-22(32)21(31)20(30)17(10-29)35-26/h2-6,9,11,16-17,20-22,25-27,29-32,34H,1,7-8,10H2/t11-,16-,17-,20-,21+,22-,25+,26+/m1/s1
C26H28N2O9512.50858700
24704425

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H28N2O9/c1-14-21(28-24(32)18-10-7-11-20(22(18)31)27-13-29)26(34)36-15(2)23(37-16(3)30)19(25(33)35-14)12-17-8-5-4-6-9-17/h4-11,13-15,19,21,23,31H,12H2,1-3H3,(H,27,29)(H,28,32)/t14-,15+,19-,21+,23+/m1/s1
C26H28N2O9512.50857700
58173087

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C26H28N2O9/c1-13-10-20(31)23(26(33)37-13)17(16-7-9-21(34-3)25(36-5)24(16)35-4)12-22(32)28-15-6-8-19(30)18(11-15)27-14(2)29/h6-11,17,30-31H,12H2,1-5H3,(H,27,29)(H,28,32)
C26H28N2O9512.50857500
24717497

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H28N2O9/c1-4-17-22(37-24(32)16-9-6-5-7-10-16)15(3)36-26(34)20(14(2)35-25(17)33)28-23(31)18-11-8-12-19(21(18)30)27-13-29/h5-15,17,20,22,30H,4H2,1-3H3,(H,27,29)(H,28,31)/t14-,15+,17-,20+,22+/m1/s1
C26H28N2O9512.50856600
8544586

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C26H28N2O9/c1-2-11-14-9-16-19-13(12-5-3-4-6-15(12)27-19)7-8-28(16)23(33)18(14)24(34)36-25(11)37-26-22(32)21(31)20(30)17(10-29)35-26/h2-6,9,11,16-17,20-22,25-27,29-32,34H,1,7-8,10H2/t11-,16+,17-,20-,21+,22-,25+,26+/m1/s1
C26H28N2O9512.50855400
10834189
InChI=1/C22H24N2O.2C2H2O4/c1-16-9-11-20(12-10-16)24-17(2)13-21(18(24)3)22(25)15-23-14-19-7-5-4-6-8-19;2*3-1(4)2(5)6/h4-13,23H,14-15H2,1-3H3;2*(H,3,4)(H,5,6)
C26H28N2O9512.50853200
8227682

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C26H28N2O9/c1-2-11-14-9-16-19-13(12-5-3-4-6-15(12)27-19)7-8-28(16)23(33)18(14)24(34)36-25(11)37-26-22(32)21(31)20(30)17(10-29)35-26/h2-6,9,11,14,17,20-22,25-27,29-32,34H,1,7-8,10H2/t11-,14+,17-,20-,21+,22-,25+,26+/m1/s1
C26H28N2O9512.50853200
2751804

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C26H28N2O9/c1-13(29)26(25(33)34)20-19(22(30)28(23(20)31)12-14-8-6-5-7-9-14)21(27-26)16-10-15(35-2)11-17(36-3)18(16)24(32)37-4/h5-11,13,19-21,27,29H,12H2,1-4H3,(H,33,34)
C26H28N2O9512.508522100
2960737

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C26H28N2O9/c1-5-13-6-8-14(9-7-13)28-22(30)19-20(23(28)31)26(12-29,25(33)34)27-21(19)16-10-15(35-2)11-17(36-3)18(16)24(32)37-4/h6-11,19-21,27,29H,5,12H2,1-4H3,(H,33,34)
C26H28N2O9512.508522100
4475624

5 of 8 defined stereocentres - 5/8 defined
InChI=1/C26H28N2O9/c1-2-12-15(9-18-20-14(7-8-27-18)13-5-3-4-6-17(13)28-20)16(24(33)34)11-35-25(12)37-26-23(32)22(31)21(30)19(10-29)36-26/h2-8,11-12,15,19,21-23,25-26,28-32H,1,9-10H2,(H,33,34)/t12?,15?,19-,21-,22+,23-,25?,26+/m1/s1
C26H28N2O9512.50852200
4478201

5 of 8 defined stereocentres - 5/8 defined
InChI=1/C26H28N2O9/c1-2-11-14-9-16-19-13(12-5-3-4-6-15(12)27-19)7-8-28(16)23(33)18(14)24(34)36-25(11)37-26-22(32)21(31)20(30)17(10-29)35-26/h2-6,9,11,16-17,20-22,25-27,29-32,34H,1,7-8,10H2/t11-,16-,17-,20?,21+,22?,25?,26+/m1/s1
C26H28N2O9512.50852200
62314858

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C26H28N2O9/c1-2-12-15(9-18-20-14(7-8-27-18)13-5-3-4-6-17(13)28-20)16(24(33)34)11-35-25(12)37-26-23(32)22(31)21(30)19(10-29)36-26/h2-8,11-12,15,19,21-23,25-26,28-32H,1,9-10H2,(H,33,34)/t12-,15+,19-,21+,22+,23+,25+,26+/m0/s1
C26H28N2O9512.50852200
62315259

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C26H28N2O9/c1-2-12-15(9-18-20-14(7-8-27-18)13-5-3-4-6-17(13)28-20)16(24(33)34)11-35-25(12)37-26-23(32)22(31)21(30)19(10-29)36-26/h2-8,11-12,15,19,21-23,25-26,28-32H,1,9-10H2,(H,33,34)/t12-,15-,19-,21+,22+,23+,25+,26+/m0/s1
C26H28N2O9512.50852200
62472178

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H28N2O9/c1-5-13-6-8-14(9-7-13)28-22(30)19-20(23(28)31)26(12-29,25(33)34)27-21(19)16-10-15(35-2)11-17(36-3)18(16)24(32)37-4/h6-11,19-21,27,29H,5,12H2,1-4H3,(H,33,34)/t19-,20+,21+,26-/m1/s1
C26H28N2O9512.50852200
62566706

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C26H28N2O9/c1-4-35-24(31)16-10-17(25(32)36-5-2)12-19(11-16)27-22(29)15-37-26(33)18-13-23(30)28(14-18)20-8-6-7-9-21(20)34-3/h6-12,18H,4-5,13-15H2,1-3H3,(H,27,29)/t18-/m0/s1
C26H28N2O9512.50852200
62570112

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C26H28N2O9/c1-2-12-15(9-18-20-14(7-8-27-18)13-5-3-4-6-17(13)28-20)16(24(33)34)11-35-25(12)37-26-23(32)22(31)21(30)19(10-29)36-26/h2-8,11-12,15,19,21-23,25-26,28-32H,1,9-10H2,(H,33,34)/t12-,15-,19+,21-,22-,23-,25-,26-/m1/s1
C26H28N2O9512.50852400
1234

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