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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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Isotopically Labeled
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Found 25 results

Search term: C28H32O18 (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10290042

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-25-11(32)5-12-15(18(25)35)19(36)26(24(43-12)8-2-3-9(30)10(31)4-8)46-28-23(40)21(38)17(34)14(45-28)7-42-27-22(39)20(37)16(33)13(6-29)44-27/h2-5,13-14,16-17,20-23,27-35,37-40H,6-7H2,1H3/t13-,14-,16-,17-,20+,21+,22-,23-,27-,28+/m1/s1
C28H32O18656.54298600
23283127

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-21-7(23-17(35)15(33)13(31)11(5-29)43-23)3-9-25(19(21)37)45-28(40)10-4-8(22(42-2)20(38)26(10)46-27(9)39)24-18(36)16(34)14(32)12(6-30)44-24/h3-4,11-18,23-24,29-38H,5-6H2,1-2H3/t11-,12-,13-,14-,15+,16+,17-,18-,23+,24+/m1/s1
C28H32O18656.54294300
4589847

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-25-12(5-11-15(19(25)36)18(35)22(39)24(42-11)8-2-3-9(31)10(32)4-8)43-28-26(21(38)17(34)14(7-30)45-28)46-27-23(40)20(37)16(33)13(6-29)44-27/h2-5,13-14,16-17,20-21,23,26-34,36-40H,6-7H2,1H3/t13-,14-,16-,17-,20+,21+,23-,26-,27+,28-/m1/s1
C28H32O18656.54294300
9171102

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-23-12(34)5-11(33)15-18(37)25(22(44-24(15)23)8-2-3-9(31)10(32)4-8)45-28-26(20(39)17(36)14(7-30)43-28)46-27-21(40)19(38)16(35)13(6-29)42-27/h2-5,13-14,16-17,19-21,26-36,38-40H,6-7H2,1H3/t13-,14-,16-,17-,19+,20+,21-,26-,27+,28+/m1/s1
C28H32O18656.54292100
32766136

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C28H32O18/c1-41-21-7(23-17(35)15(33)13(31)11(5-29)43-23)3-9-25(19(21)37)45-28(40)10-4-8(22(42-2)20(38)26(10)46-27(9)39)24-18(36)16(34)14(32)12(6-30)44-24/h3-4,11-18,23-24,29-38H,5-6H2,1-2H3/t11-,12-,13-,14-,15+,16+,17-,18-,23+,24?/m1/s1
C28H32O18656.54292200
76790953

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-7-15(33)19(37)21(39)27(42-7)46-26-18(36)14-9(30)5-12(41-2)24(45-28-22(40)20(38)17(35)13(6-29)43-28)25(14)44-23(26)8-3-10(31)16(34)11(32)4-8/h3-5,7,13,15,17,19-22,27-35,37-40H,6H2,1-2H3/t7-,13+,15-,17+,19+,20-,21+,22+,27-,28-/m0/s1
C28H32O18656.54292200
90637724

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-25-11(32)5-12-15(18(25)35)19(36)26(24(43-12)8-2-3-9(30)10(31)4-8)46-28-23(40)21(38)17(34)14(45-28)7-42-27-22(39)20(37)16(33)13(6-29)44-27/h2-5,13-14,16-17,20-23,27-35,37-40H,6-7H2,1H3/t13-,14-,16-,17+,20+,21+,22-,23-,27-,28+/m1/s1
C28H32O18656.54291100
90658059

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-25-12(43-27-22(39)20(37)16(33)13(6-29)44-27)5-11-15(18(25)35)19(36)26(24(42-11)8-2-3-9(31)10(32)4-8)46-28-23(40)21(38)17(34)14(7-30)45-28/h2-5,13-14,16-17,20-23,27-35,37-40H,6-7H2,1H3/t13-,14-,16-,17+,20+,21+,22-,23-,27-,28+/m1/s1
C28H32O18656.54291100
115269833

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-7-14(32)18(36)21(39)27(42-7)46-26-20(38)17(35)13(6-29)43-28(26)45-25-11(31)5-9-15(33)19(37)23(44-24(9)22(25)40)8-3-10(30)16(34)12(4-8)41-2/h3-5,7,13-14,17-18,20-21,26-32,34-40H,6H2,1-2H3/t7-,13+,14-,17+,18+,20-,21+,26+,27-,28-/m0/s1
C28H32O18656.54291100
115270213

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-12-2-8(3-13(17(12)33)43-27-23(39)21(37)18(34)14(6-29)44-27)25-26(20(36)16-10(32)4-9(31)5-11(16)42-25)46-28-24(40)22(38)19(35)15(7-30)45-28/h2-5,14-15,18-19,21-24,27-35,37-40H,6-7H2,1H3/t14-,15-,18-,19-,21+,22+,23-,24-,27-,28+/m1/s1
C28H32O18656.54291100
115270229

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-24-11(33)2-8(3-12(24)34)23-26(18(36)16-10(32)4-9(31)5-13(16)42-23)46-28-22(40)20(38)25(15(7-30)44-28)45-27-21(39)19(37)17(35)14(6-29)43-27/h2-5,14-15,17,19-22,25,27-35,37-40H,6-7H2,1H3/t14-,15-,17+,19+,20-,21-,22-,25+,27+,28+/m1/s1
C28H32O18656.54291100
115270349

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-25-12(43-27-22(39)20(37)16(33)13(6-29)44-27)5-11-15(18(25)35)19(36)26(24(42-11)8-2-3-9(31)10(32)4-8)46-28-23(40)21(38)17(34)14(7-30)45-28/h2-5,13-14,16-17,20-23,27-35,37-40H,6-7H2,1H3/t13-,14-,16-,17-,20+,21+,22-,23-,27-,28+/m1/s1
C28H32O18656.54291100
115270390

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-12-5-11-15(18(35)16(12)33)19(36)26(24(42-11)8-2-3-9(31)10(32)4-8)46-28-23(40)21(38)25(14(7-30)44-28)45-27-22(39)20(37)17(34)13(6-29)43-27/h2-5,13-14,17,20-23,25,27-35,37-40H,6-7H2,1H3/t13-,14-,17-,20+,21-,22-,23-,25-,27+,28+/m1/s1
C28H32O18656.54291100
115270432

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-12-5-11(33)15-18(36)26(46-28-22(40)20(38)17(35)14(7-30)43-28)23(8-2-3-9(31)10(32)4-8)44-25(15)24(12)45-27-21(39)19(37)16(34)13(6-29)42-27/h2-5,13-14,16-17,19-22,27-35,37-40H,6-7H2,1H3/t13-,14-,16-,17+,19+,20+,21-,22-,27+,28+/m1/s1
C28H32O18656.54291100
115270437

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-24-12(42-27-21(39)19(37)16(34)13(6-29)43-27)5-11(33)15-18(36)26(46-28-22(40)20(38)17(35)14(7-30)44-28)23(45-25(15)24)8-2-3-9(31)10(32)4-8/h2-5,13-14,16-17,19-22,27-35,37-40H,6-7H2,1H3/t13-,14-,16-,17-,19+,20+,21-,22-,27-,28+/m1/s1
C28H32O18656.54291100
129170905

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C28H32O18/c1-40-11-3-8(4-12(41-2)16(11)32)10-5-9(31)15-19(35)25(45-28-22(38)20(36)17(33)13(6-29)43-28)23(39)26(24(15)42-10)46-27-21(37)18(34)14(7-30)44-27/h3-5,13-14,17-18,20-22,27-30,32-39H,6-7H2,1-2H3/t13-,14-,17-,18-,20+,21+,22-,27?,28?/m1/s1
C28H32O18656.54291100
58843297

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H32O18/c1-41-21-7(23-17(35)15(33)13(31)11(5-29)43-23)3-9-25(19(21)37)45-28(40)10-4-8(22(42-2)20(38)26(10)46-27(9)39)24-18(36)16(34)14(32)12(6-30)44-24/h3-4,11-18,23-24,29-38H,5-6H2,1-2H3/t11-,12-,13-,14-,15+,16+,17-,18-,23-,24+/m1/s1
C28H32O18656.54291100
24845564

6 of 10 defined stereocentres - 6/10 defined
InChI=1/C28H32O18/c1-41-12-5-11-15(18(35)16(12)33)19(36)26(24(42-11)8-2-3-9(31)10(32)4-8)46-28-23(40)21(38)25(14(7-30)44-28)45-27-22(39)20(37)17(34)13(6-29)43-27/h2-5,13-14,17,20-23,25,27-35,37-40H,6-7H2,1H3/t13?,14?,17-,20+,21-,22?,23?,25-,27+,28+/m1/s1
C28H32O18656.54291100
24845707

5 of 10 defined stereocentres - 5/10 defined
InChI=1/C28H32O18/c1-41-12-5-11(33)15-18(36)26(46-28-22(40)20(38)17(35)14(7-30)43-28)23(8-2-3-9(31)10(32)4-8)44-25(15)24(12)45-27-21(39)19(37)16(34)13(6-29)42-27/h2-5,13-14,16-17,19-22,27-35,37-40H,6-7H2,1H3/t13?,14?,16-,17+,19+,20?,21?,22?,27+,28+/m1/s1
C28H32O18656.54291100
24845717

5 of 10 defined stereocentres - 5/10 defined
InChI=1/C28H32O18/c1-41-24-12(42-27-21(39)19(37)16(34)13(6-29)43-27)5-11(33)15-18(36)26(46-28-22(40)20(38)17(35)14(7-30)44-28)23(45-25(15)24)8-2-3-9(31)10(32)4-8/h2-5,13-14,16-17,19-22,27-35,37-40H,6-7H2,1H3/t13?,14?,16-,17-,19+,20?,21?,22?,27-,28+/m1/s1
C28H32O18656.54291100
12

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