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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
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
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Found 60 results

Search term: C26H26O12 (Found by molecular formula)
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8228278

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H26O12/c1-36-25(34)26(35)12-20(31)24(38-23(33)9-5-15-3-7-17(28)19(30)11-15)21(13-26)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h2-11,20-21,24,27-31,35H,12-13H2,1H3/b8-4+,9-5+/t20-,21-,24+,26-/m1/s1
C26H26O12530.4774171400
24692051

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H26O12/c1-36-25(34)26(35)12-20(37-22(31)8-4-14-2-6-16(27)18(29)10-14)24(33)21(13-26)38-23(32)9-5-15-3-7-17(28)19(30)11-15/h2-11,20-21,24,27-30,33,35H,12-13H2,1H3/b8-4+,9-5+/t20-,21-,24-,26+/m1/s1
C26H26O12530.4774121200
8567660

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H26O12/c1-36-25(34)26(35)12-20(31)24(38-23(33)9-5-15-3-7-17(28)19(30)11-15)21(13-26)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h2-11,20-21,24,27-31,35H,12-13H2,1H3/b8-4+,9-5+/t20-,21-,24-,26+/m1/s1
C26H26O12530.4774121300
114308

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C26H26O12/c1-9(28)26(35)6-11-16(13(7-26)37-25-24(34)21(31)14(8-27)38-25)23(33)18-17(20(11)30)19(29)10-4-3-5-12(36-2)15(10)22(18)32/h3-5,13-14,21,24-25,27,30-31,33-35H,6-8H2,1-2H3/t13-,14+,21+,24+,25+,26-/m0/s1
C26H26O12530.47747600
8251219

Double-bond stereo

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C26H26O12/c1-36-25(34)26(35)12-20(37-22(31)8-4-14-2-6-16(27)18(29)10-14)24(33)21(13-26)38-23(32)9-5-15-3-7-17(28)19(30)11-15/h2-11,20-21,24,27-30,33,35H,12-13H2,1H3/b8-4+,9-5+/t20-,21-,24?,26?/m1/s1
C26H26O12530.47747500
67868436

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H26O12/c1-25(38-22(32)9-5-15-3-7-17(28)19(30)11-15)13-26(36,24(34)35)12-20(23(25)33)37-21(31)8-4-14-2-6-16(27)18(29)10-14/h2-11,20,23,27-30,33,36H,12-13H2,1H3,(H,34,35)/b8-4+,9-5+/t20-,23+,25-,26-/m1/s1
C26H26O12530.47747700
30777585

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H26O12/c1-36-20-11-15(3-7-17(20)28)4-8-22(31)37-21-13-26(25(34)35,12-19(30)24(21)33)38-23(32)9-5-14-2-6-16(27)18(29)10-14/h2-11,19,21,24,27-30,33H,12-13H2,1H3,(H,34,35)/b8-4+,9-5+/t19-,21-,24+,26-/m1/s1
C26H26O12530.47746700
4477534

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C26H26O12/c1-36-25(34)26(35)12-20(37-22(31)8-4-14-2-6-16(27)18(29)10-14)24(33)21(13-26)38-23(32)9-5-15-3-7-17(28)19(30)11-15/h2-11,20-21,24,27-30,33,35H,12-13H2,1H3/b8-4+,9-5+
C26H26O12530.47745500
29814859

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H26O12/c1-36-20-7-3-15(11-18(20)29)5-9-23(32)38-24-19(30)12-26(35,25(33)34)13-21(24)37-22(31)8-4-14-2-6-16(27)17(28)10-14/h2-11,19,21,24,27-30,35H,12-13H2,1H3,(H,33,34)/b8-4+,9-5+/t19-,21-,24+,26-/m1/s1
C26H26O12530.47745300
22905582

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C26H26O12/c1-3-4-21(30)35-11-20-23(31)24(32)25(33)26(38-20)36-13-8-15(28)22-16(29)10-17(37-19(22)9-13)12-5-6-14(27)18(7-12)34-2/h3-10,20,23-28,31-33H,11H2,1-2H3/b4-3+
C26H26O12530.47744200
4977014

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C26H26O12/c1-33-17-9-5-15(13-19(17)35-3)7-11-21(27)37-23(25(29)30)24(26(31)32)38-22(28)12-8-16-6-10-18(34-2)20(14-16)36-4/h5-14,23-24H,1-4H3,(H,29,30)(H,31,32)/b11-7+,12-8+/t23-,24-/m1/s1
C26H26O12530.47744300
387458

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C26H26O12/c1-9(28)26(35)6-11-16(13(7-26)37-25-24(34)21(31)14(8-27)38-25)23(33)18-17(20(11)30)19(29)10-4-3-5-12(36-2)15(10)22(18)32/h3-5,13-14,21,24-25,27,30-31,33-35H,6-8H2,1-2H3
C26H26O12530.47744300
9224887

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H26O12/c27-7-19-22(28)23(29)24(30)26(38-19)33-9-14-8-32-25(31)21(14)20(12-1-3-15-17(5-12)36-10-34-15)13-2-4-16-18(6-13)37-11-35-16/h1-6,19-20,22-24,26-30H,7-11H2/t19-,22-,23+,24-,26-/m1/s1
C26H26O12530.47744310
30777586

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H26O12/c1-36-20-11-15(3-7-17(20)28)5-9-23(32)38-26(25(34)35)12-19(30)24(33)21(13-26)37-22(31)8-4-14-2-6-16(27)18(29)10-14/h2-11,19,21,24,27-30,33H,12-13H2,1H3,(H,34,35)/b8-4+,9-5+/t19-,21-,24+,26-/m1/s1
C26H26O12530.47744400
34999585

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H26O12/c1-3-11(2)25(34)37-17-5-4-12(6-14(17)28)18-9-16(30)21-15(29)7-13(8-19(21)36-18)35-26-24(33)23(32)22(31)20(10-27)38-26/h3-9,20,22-24,26-29,31-33H,10H2,1-2H3/b11-3-/t20-,22-,23+,24-,26-/m1/s1
C26H26O12530.47744500
52084852

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H26O12/c1-36-20-11-15(3-7-17(20)28)5-8-22(31)37-21-13-26(35,25(33)34)12-19(30)24(21)38-23(32)9-4-14-2-6-16(27)18(29)10-14/h2-11,19,21,24,27-30,35H,12-13H2,1H3,(H,33,34)/b8-5+,9-4+/t19-,21-,24-,26+/m1/s1
C26H26O12530.47743400
28639021

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H26O12/c1-26(2)6-5-11-15(38-26)8-14(30)17-19(32)24(37-25-21(34)20(33)18(31)16(9-27)35-25)22(36-23(11)17)10-3-4-12(28)13(29)7-10/h3-8,16,18,20-21,25,27-31,33-34H,9H2,1-2H3/t16-,18-,20+,21-,25+/m1/s1
C26H26O12530.47743400
10223620

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H26O12/c1-9(27)15-13(29)7-25(35)22-24(8-14(38-22)23(2,3)34)17(21(33)26(25,36)20(15)32)18(30)16-11(19(24)31)5-10(37-4)6-12(16)28/h5-6,14,22,27-28,33-36H,7-8H2,1-4H3/b15-9+/t14-,22+,24+,25+,26-/m1/s1
C26H26O12530.47743300
10255196

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H26O12/c1-9(27)15-13(29)7-25(35)22-24(8-14(38-22)23(2,3)34)17(21(33)26(25,36)20(15)32)18(30)16-11(19(24)31)5-10(37-4)6-12(16)28/h5-6,14,22,27-28,33-36H,7-8H2,1-4H3/b15-9+/t14-,22+,24+,25-,26+/m0/s1
C26H26O12530.47743300
4477533

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C26H26O12/c1-36-25(34)26(35)12-20(31)24(38-23(33)9-5-15-3-7-17(28)19(30)11-15)21(13-26)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h2-11,20-21,24,27-31,35H,12-13H2,1H3/b8-4+,9-5+
C26H26O12530.47743300
123

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