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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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Single/Multi-component
Isotopically Labeled
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Found 9 results

Search term: C31H34O19 (Found by molecular formula)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8525308

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C31H34O19/c1-10(32)44-8-19-22(38)25(41)27(43)30(48-19)50-29-26(42)23(39)20(9-45-11(2)33)49-31(29)47-18-7-16(37)21-15(36)6-17(46-28(21)24(18)40)12-3-4-13(34)14(35)5-12/h3-7,19-20,22-23,25-27,29-31,34-35,37-43H,8-9H2,1-2H3/t19-,20-,22-,23-,25-,26+,27-,29-,30+,31-/m1/s1
C31H34O19710.59033200
8946383

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C31H34O19/c1-10-27(49-19(38)5-4-18(36)37)24(42)26(44)30(46-10)45-9-17-21(39)23(41)25(43)31(48-17)50-29-22(40)20-15(35)7-12(32)8-16(20)47-28(29)11-2-3-13(33)14(34)6-11/h2-3,6-8,10,17,21,23-27,30-35,39,41-44H,4-5,9H2,1H3,(H,36,37)/t10-,17+,21+,23-,24-,25+,26+,27-,30+,31-/m0/s1
C31H34O19710.59032100
9825322

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C31H34O19/c1-10(32)44-8-18-22(39)25(42)29(46-11(2)33)31(49-18)45-9-19-21(38)24(41)26(43)30(48-19)50-28-23(40)20-16(37)6-13(34)7-17(20)47-27(28)12-3-4-14(35)15(36)5-12/h3-7,18-19,21-22,24-26,29-31,34-39,41-43H,8-9H2,1-2H3/t18-,19-,21-,22-,24+,25+,26-,29-,30+,31-/m1/s1
C31H34O19710.59032100
82965028

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C31H34O19/c1-44-13-6-14(33)20-15(7-13)47-28(11-2-4-12(5-3-11)46-30-26(42)24(40)21(37)16(9-32)48-30)29(23(20)39)50-31-27(43)25(41)22(38)17(49-31)10-45-19(36)8-18(34)35/h2-7,16-17,21-22,24-27,30-33,37-38,40-43H,8-10H2,1H3,(H,34,35)/t16-,17-,21-,22-,24+,25+,26-,27-,30-,31+/m0/s1
C31H34O19710.59032100
115269373

10 of 11 defined stereocentres - 10/11 defined
InChI=1/C31H34O19/c32-8-17-22(37)25(40)27(42)29(48-17)21-16(7-15-20(24(21)39)12(34)5-14(47-15)10-1-3-11(33)4-2-10)49-31-28(43)26(41)23(38)18(50-31)9-46-19(36)6-13(35)30(44)45/h1-5,7,13,17-18,22-23,25-29,31-33,35,37-43H,6,8-9H2,(H,44,45)/t13?,17-,18-,22-,23-,25+,26+,27-,28-,29+,31-/m1/s1
C31H34O19710.59031100
115269790

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C31H34O19/c1-10(33)44-9-20-22(39)25(42)26(43)30(49-20)50-29-28(45-11(2)34)24(41)19(8-32)48-31(29)47-18-7-16(38)21-15(37)6-17(46-27(21)23(18)40)12-3-4-13(35)14(36)5-12/h3-7,19-20,22,24-26,28-32,35-36,38-43H,8-9H2,1-2H3/t19-,20-,22-,24-,25-,26-,28+,29-,30+,31-/m1/s1
C31H34O19710.59031100
24843370

6 of 11 defined stereocentres - 6/11 defined
InChI=1/C31H34O19/c32-8-17-22(37)25(40)27(42)29(48-17)21-16(7-15-20(24(21)39)12(34)5-14(47-15)10-1-3-11(33)4-2-10)49-31-28(43)26(41)23(38)18(50-31)9-46-19(36)6-13(35)30(44)45/h1-5,7,13,17-18,22-23,25-29,31-33,35,37-43H,6,8-9H2,(H,44,45)/t13?,17?,18?,22-,23-,25+,26+,27?,28?,29+,31-/m1/s1
C31H34O19710.59031100
24844238

6 of 10 defined stereocentres - 6/10 defined
InChI=1/C31H34O19/c1-10(32)44-8-19-22(38)25(41)27(43)30(48-19)50-29-26(42)23(39)20(9-45-11(2)33)49-31(29)47-18-7-16(37)21-15(36)6-17(46-28(21)24(18)40)12-3-4-13(34)14(35)5-12/h3-7,19-20,22-23,25-27,29-31,34-35,37-43H,8-9H2,1-2H3/t19?,20?,22-,23-,25+,26+,27?,29?,30+,31-/m1/s1
C31H34O19710.59031100
24844239

6 of 10 defined stereocentres - 6/10 defined
InChI=1/C31H34O19/c1-10(33)44-9-20-22(39)25(42)26(43)30(49-20)50-29-28(45-11(2)34)24(41)19(8-32)48-31(29)47-18-7-16(38)21-15(37)6-17(46-27(21)23(18)40)12-3-4-13(35)14(36)5-12/h3-7,19-20,22,24-26,28-32,35-36,38-43H,8-9H2,1-2H3/t19?,20?,22-,24-,25+,26?,28+,29?,30+,31-/m1/s1
C31H34O19710.59031100

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