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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
Additional Filters

Found 56 results

Search term: C32H44O14 (Found by molecular formula)
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8637354

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C32H44O14/c1-17(11-7-13-19(3)29(40)41)9-5-6-10-18(2)12-8-14-20(4)30(42)46-32-28(39)26(37)24(35)22(45-32)16-43-31-27(38)25(36)23(34)21(15-33)44-31/h5-14,21-28,31-39H,15-16H2,1-4H3,(H,40,41)/b6-5+,11-7+,12-8+,17-9+,18-10+,19-13+,20-14+/t21-,22-,23-,24-,25+,26+,27-,28-,31-,32+/m1/s1
C32H44O14652.6834315300
10237133

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C32H44O14/c1-14-21(41-15(2)33)12-32(39)28(46-20(7)38)26-30(10,22(42-16(3)34)11-23(43-17(4)35)31(26)13-40-31)27(45-19(6)37)25(44-18(5)36)24(14)29(32,8)9/h21-23,25-28,39H,11-13H2,1-10H3/t21-,22-,23-,25+,26-,27-,28-,30+,31+,32+/m0/s1
C32H44O14652.6834231912
10295377

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C32H44O14/c1-14-21(41-15(2)33)12-32(39)28(45-19(6)37)26-30(10,22(42-16(3)34)11-23-31(26,13-40-23)46-20(7)38)27(44-18(5)36)25(43-17(4)35)24(14)29(32,8)9/h21-23,25-28,39H,11-13H2,1-10H3/t21-,22-,23+,25+,26-,27-,28-,30+,31-,32+/m0/s1
C32H44O14652.6834151000
26332862

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C32H44O14/c1-17(11-7-13-19(3)29(41)45-31-27(39)25(37)23(35)21(15-33)43-31)9-5-6-10-18(2)12-8-14-20(4)30(42)46-32-28(40)26(38)24(36)22(16-34)44-32/h5-14,21-28,31-40H,15-16H2,1-4H3/b6-5+,11-7+,12-8+,17-9+,18-10+,19-13+,20-14+/t21-,22-,23-,24-,25+,26+,27-,28-,31+,32+/m1/s1
C32H44O14652.6834151800
383324

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C32H44O14/c1-14-21(41-15(2)33)12-32(39)28(46-20(7)38)26-30(10,22(42-16(3)34)11-23(43-17(4)35)31(26)13-40-31)27(45-19(6)37)25(44-18(5)36)24(14)29(32,8)9/h21-23,25-28,39H,11-13H2,1-10H3
C32H44O14652.6834151600
4476769

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C32H44O14/c1-14-21(41-15(2)33)12-32(39)28(46-20(7)38)26-30(10,22(42-16(3)34)11-23(43-17(4)35)31(26)13-40-31)27(45-19(6)37)25(44-18(5)36)24(14)29(32,8)9/h21-23,25-28,39H,11-13H2,1-10H3/t21-,22-,23-,25+,26-,27-,28-,30+,31-,32+/m0/s1
C32H44O14652.6834131100
57257175

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C32H44O14/c1-14-21(41-15(2)33)12-32(46-20(7)38)28(45-19(6)37)26-30(10,23(42-16(3)34)11-22(39)31(26)13-40-31)27(44-18(5)36)25(43-17(4)35)24(14)29(32,8)9/h21-23,25-28,39H,11-13H2,1-10H3/t21-,22-,23-,25+,26-,27-,28-,30+,31+,32+/m0/s1
C32H44O14652.68348700
337123

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C32H44O14/c1-14-21(41-15(2)33)12-31(29(8,9)39)24(14)25(44-18(5)36)27(45-19(6)37)30(10)22(42-16(3)34)11-23(43-17(4)35)32(13-40-32)26(30)28(31)46-20(7)38/h21-23,25-28,39H,11-13H2,1-10H3/t21-,22-,23?,25+,26-,27?,28-,30+,31-,32+/m0/s1
C32H44O14652.68344300
8253564

Double-bond stereo

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C32H44O14/c1-10-11-23(37)45-26-14(2)12-22-32(31(9,46-32)29(39)44-22)27(42-18(6)35)24-15(3)20(40-16(4)33)13-21(41-17(5)34)30(24,8)28(25(26)38)43-19(7)36/h12,15,20-22,24-28,38H,10-11,13H2,1-9H3/b14-12-/t15-,20-,21-,22-,24+,25-,26+,27-,28-,30-,31+,32-/m0/s1
C32H44O14652.68344300
9072868

Double-bond stereo

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C32H44O14/c1-10-11-23(37)45-26-14(2)12-22-32(31(9,46-32)29(39)44-22)27(42-18(6)35)24-15(3)20(40-16(4)33)13-21(41-17(5)34)30(24,8)28(25(26)38)43-19(7)36/h12,15,20-22,24-28,38H,10-11,13H2,1-9H3/b14-12-/t15-,20-,21-,22-,24+,25-,26+,27-,28-,30-,31-,32-/m0/s1
C32H44O14652.68344300
30811869

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C32H44O14/c1-14-21(41-15(2)33)12-31(29(8,9)39)24(14)25(44-18(5)36)27(45-19(6)37)30(10)22(42-16(3)34)11-23(43-17(4)35)32(13-40-32)26(30)28(31)46-20(7)38/h21-23,25-28,39H,11-13H2,1-10H3/t21-,22-,23+,25+,26-,27+,28-,30+,31-,32+/m0/s1
C32H44O14652.68343300
17216196

Double-bond stereo

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C32H44O14/c1-17(11-7-13-19(3)29(41)45-31-27(39)25(37)23(35)21(15-33)43-31)9-5-6-10-18(2)12-8-14-20(4)30(42)46-32-28(40)26(38)24(36)22(16-34)44-32/h5-14,21-28,31-40H,15-16H2,1-4H3/b6-5+,11-7+,12-8+,17-9+,18-10+,19-13+,20-14+/t21-,22-,23-,24-,25+,26+,27-,28-,31+,32?/m1/s1
C32H44O14652.68343310
23173659

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C32H44O14/c1-5-17(2)15-18(3)11-12-22(34)44-25-24(36)30(14-13-21(33)23(35)19(4)16-20-9-7-6-8-10-20)45-26(27(37)38)31(43,28(39)40)32(25,46-30)29(41)42/h6-10,17-19,23-26,35-36,43H,5,11-16H2,1-4H3,(H,37,38)(H,39,40)(H,41,42)/t17-,18+,19-,23+,24+,25+,26+,30-,31+,32-/m0/s1
C32H44O14652.68343300
8524763
InChI=1/C32H44O14/c1-35-31(33)25-19-27-23-28(20-25)44-16-12-40-8-4-38-6-10-42-14-18-46-30-22-26(32(34)36-2)21-29(24-30)45-17-13-41-9-5-37-3-7-39-11-15-43-27/h19-24H,3-18H2,1-2H3
C32H44O14652.68343100
2766631

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C32H44O14/c1-14-21(41-15(2)33)12-31(29(8,9)39)24(14)25(44-18(5)36)27(45-19(6)37)30(10)22(42-16(3)34)11-23(43-17(4)35)32(13-40-32)26(30)28(31)46-20(7)38/h21-23,25-28,39H,11-13H2,1-10H3
C32H44O14652.6833599999983200
4479390

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C32H44O14/c1-14-21(41-15(2)33)12-31(29(8,9)39)24(14)25(44-18(5)36)27(45-19(6)37)30(10)22(42-16(3)34)11-23(43-17(4)35)32(13-40-32)26(30)28(31)46-20(7)38/h21-23,25-28,39H,11-13H2,1-10H3/t21-,22-,23-,25+,26-,27?,28-,30+,31-,32+/m0/s1
C32H44O14652.68342200
4956322
InChI=1/C12H22O4.2C8H6O4.C4H10O2/c13-11(14)9-7-5-3-1-2-4-6-8-10-12(15)16;9-7(10)5-1-2-6(4-3-5)8(11)12;9-7(10)5-2-1-3-6(4-5)8(11)12;5-3-1-2-4-6/h1-10H2,(H,13,14)(H,15,16);2*1-4H,(H,9,10)(H,11,12);5-6H,1-4H2
C32H44O14652.68342200
8230617

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C32H44O14/c1-5-17(2)11-12-21(33)16-22(34)44-25-24(36)30(14-13-18(3)23(35)19(4)15-20-9-7-6-8-10-20)45-26(27(37)38)31(43,28(39)40)32(25,46-30)29(41)42/h6-10,17,19,21,23-26,33,35-36,43H,3,5,11-16H2,1-2,4H3,(H,37,38)(H,39,40)(H,41,42)/t17?,19-,21?,23-,24-,25-,26-,30-,31-,32-/m1/s1
C32H44O14652.68342100
9988989

Double-bond stereo

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C32H44O14/c1-15-9-10-24(42-19(5)35)31(8)25(43-20(6)36)13-23(45-27(38)11-16(2)41-18(4)34)22(14-33)12-26-32(40,17(3)30(39)46-26)29(28(15)31)44-21(7)37/h9,12,16-17,23-26,28-29,33,40H,10-11,13-14H2,1-8H3/b22-12-/t16?,17-,23+,24-,25-,26-,28+,29+,31+,32-/m0/s1
C32H44O14652.68342100
10269336

Double-bond stereo

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C32H44O14/c1-15-9-10-24(42-19(5)35)31(8)25(43-20(6)36)13-23(45-27(38)11-16(2)41-18(4)34)22(14-33)12-26-32(40,17(3)30(39)46-26)29(28(15)31)44-21(7)37/h9,12,16-17,23-26,28-29,33,40H,10-11,13-14H2,1-8H3/b22-12-/t16?,17-,23+,24-,25-,26-,28+,29-,31+,32-/m0/s1
C32H44O14652.68342200
123

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