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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 15 results

Search term: C35H34O18 (Found by molecular formula)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17461966

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C35H34O18/c1-15(36)44-14-30-32(48-19(5)40)33(49-20(6)41)34(50-21(7)42)35(53-30)51-23-11-28(47-18(4)39)31-24(43)13-26(52-29(31)12-23)22-8-9-25(45-16(2)37)27(10-22)46-17(3)38/h8-13,30,32-35H,14H2,1-7H3/t30-,32-,33+,34-,35-/m1/s1
C35H34O18742.6337161200
22871069

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C35H34O18/c1-15(36)44-14-29-32(49-19(5)40)33(50-20(6)41)34(51-21(7)42)35(53-29)52-23-11-27-30(28(12-23)48-18(4)39)31(43)24(13-45-27)22-8-9-25(46-16(2)37)26(10-22)47-17(3)38/h8-13,29,32-35H,14H2,1-7H3/t29-,32-,33+,34-,35-/m1/s1
C35H34O18742.63378500
2596219

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C35H34O18/c1-15(36)44-14-29-32(49-19(5)40)33(50-20(6)41)34(51-21(7)42)35(53-29)52-23-11-27-30(28(12-23)48-18(4)39)31(43)24(13-45-27)22-8-9-25(46-16(2)37)26(10-22)47-17(3)38/h8-13,29,32-35H,14H2,1-7H3
C35H34O18742.63378400
2942098

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C35H34O18/c1-15(36)44-14-30-32(48-19(5)40)33(49-20(6)41)34(50-21(7)42)35(53-30)51-23-11-28(47-18(4)39)31-24(43)13-26(52-29(31)12-23)22-8-9-25(45-16(2)37)27(10-22)46-17(3)38/h8-13,30,32-35H,14H2,1-7H3
C35H34O18742.6336599999997400
26345735

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C35H34O18/c1-15(36)44-14-27-31(48-19(5)40)33(49-20(6)41)34(50-21(7)42)35(52-27)53-32-29(43)28-25(47-18(4)39)12-24(46-17(3)38)13-26(28)51-30(32)22-8-10-23(11-9-22)45-16(2)37/h8-13,27,31,33-35H,14H2,1-7H3/t27-,31-,33+,34-,35+/m1/s1
C35H34O18742.63375600
5036917

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C35H34O18/c1-15(36)44-14-30-32(48-19(5)40)33(49-20(6)41)34(50-21(7)42)35(53-30)51-23-11-28(47-18(4)39)31-24(43)13-26(52-29(31)12-23)22-8-9-25(45-16(2)37)27(10-22)46-17(3)38/h8-13,30,32-35H,14H2,1-7H3/t30-,32+,33+,34+,35+/m0/s1
C35H34O18742.63373300
8899056

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C35H34O18/c1-14-30(47-17(4)38)33(50-20(7)41)34(51-21(8)42)35(44-14)53-28-13-27-29(32(49-19(6)40)31(28)48-18(5)39)23(43)12-25(52-27)22-9-10-24(45-15(2)36)26(11-22)46-16(3)37/h9-14,30,33-35H,1-8H3/t14-,30-,33+,34+,35-/m0/s1
C35H34O18742.63372100
10142646

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C35H34O18/c36-16-5-1-14(2-6-16)3-8-24(42)52-33-29(46)27(44)23(13-49-34-30(47)26(43)21(41)12-48-34)51-35(33)53-32-28(45)25-20(40)10-17(37)11-22(25)50-31(32)15-4-7-18(38)19(39)9-15/h1-11,21,23,26-27,29-30,33-41,43-44,46-47H,12-13H2/b8-3+/t21-,23-,26-,27+,29-,30-,33-,34+,35+/m1/s1
C35H34O18742.63372200
10142647

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C35H34O18/c36-16-5-1-14(2-6-16)3-8-24(42)52-33-29(46)27(44)23(13-49-34-30(47)26(43)21(41)12-48-34)51-35(33)53-32-28(45)25-20(40)10-17(37)11-22(25)50-31(32)15-4-7-18(38)19(39)9-15/h1-11,21,23,26-27,29-30,33-41,43-44,46-47H,12-13H2/b8-3+/t21-,23-,26-,27-,29-,30-,33-,34+,35+/m1/s1
C35H34O18742.63372200
10143539

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C35H34O18/c1-15(36)44-14-30-32(48-19(5)40)33(49-20(6)41)34(50-21(7)42)35(53-30)51-23-11-28(47-18(4)39)31-24(43)13-26(52-29(31)12-23)22-8-9-25(45-16(2)37)27(10-22)46-17(3)38/h8-13,30,32-35H,14H2,1-7H3/t30?,32-,33+,34?,35-/m1/s1
C35H34O18742.63372200
58837476

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C35H34O18/c36-16-9-20(39)17-11-25(32(50-24(17)10-16)15-3-5-19(38)22(41)8-15)51-35-33(53-34-31(47)28(44)23(42)12-49-34)30(46)29(45)26(52-35)13-48-27(43)6-2-14-1-4-18(37)21(40)7-14/h1-11,23,26,28-31,33-35,42,44-47H,12-13H2,(H5-,36,37,38,39,40,41,43)/t23-,26-,28+,29-,30+,31-,33-,34+,35-/m1/s1
C35H34O18742.63372200
115269490

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C35H34O18/c36-16-5-1-14(2-6-16)3-8-24(42)52-33-29(46)27(44)23(13-49-34-30(47)26(43)21(41)12-48-34)51-35(33)53-32-28(45)25-20(40)10-17(37)11-22(25)50-31(32)15-4-7-18(38)19(39)9-15/h1-11,21,23,26-27,29-30,33-41,43-44,46-47H,12-13H2/b8-3+/t21-,23+,26-,27+,29-,30+,33+,34-,35-/m0/s1
C35H34O18742.63371100
28284546

Double-bond stereo

5 of 9 defined stereocentres - 5/9 defined
InChI=1/C35H34O18/c36-12-23-27(45)29(47)33(53-34-32(26(44)21(42)13-48-34)51-24(43)8-2-14-1-7-18(39)19(40)9-14)35(50-23)52-31-28(46)25-20(41)10-17(38)11-22(25)49-30(31)15-3-5-16(37)6-4-15/h1-11,21,23,26-27,29,32-42,44-45,47H,12-13H2/b8-2+/t21?,23-,26+,27?,29+,32-,33?,34+,35?/m0/s1
C35H34O18742.63371100
4481072

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C35H34O18/c36-16-5-1-14(2-6-16)3-8-24(42)52-33-29(46)27(44)23(13-49-34-30(47)26(43)21(41)12-48-34)51-35(33)53-32-28(45)25-20(40)10-17(37)11-22(25)50-31(32)15-4-7-18(38)19(39)9-15/h1-11,21,23,26-27,29-30,33-41,43-44,46-47H,12-13H2/b8-3+/t21-,23+,26-,27-,29-,30-,33-,34+,35+/m1/s1
C35H34O18742.63371100
24843606

Double-bond stereo

5 of 9 defined stereocentres - 5/9 defined
InChI=1/C35H34O18/c36-16-5-1-14(2-6-16)3-8-24(42)52-33-29(46)27(44)23(13-49-34-30(47)26(43)21(41)12-48-34)51-35(33)53-32-28(45)25-20(40)10-17(37)11-22(25)50-31(32)15-4-7-18(38)19(39)9-15/h1-11,21,23,26-27,29-30,33-41,43-44,46-47H,12-13H2/b8-3+/t21?,23?,26-,27+,29-,30?,33?,34-,35-/m0/s1
C35H34O18742.63371100

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