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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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Found 122 results

Search term: C27H32O9 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
28518885

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C27H32O9/c1-13(2)18(29)10-16-9-17(8-15(22(16)31)7-6-14(3)12-28)25-27(35-5)24(33)21-20(36-25)11-19(30)26(34-4)23(21)32/h8-9,11,14,18,28-32H,1,6-7,10,12H2,2-5H3
C27H32O9500.5376221800
1729112

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C27H32O9/c1-29-19-9-5-7-17(21(19)31-3)23-33-13-26(14-34-23)11-12-27(25(26)28)15-35-24(36-16-27)18-8-6-10-20(30-2)22(18)32-4/h5-10,23-24H,11-16H2,1-4H3
C27H32O9500.537611500
1727832

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C27H32O9/c1-29-17-5-7-21(31-3)19(11-17)23-33-13-26(14-34-23)9-10-27(25(26)28)15-35-24(36-16-27)20-12-18(30-2)6-8-22(20)32-4/h5-8,11-12,23-24H,9-10,13-16H2,1-4H3
C27H32O9500.537610500
62782736

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C27H32O9/c1-13(12-28)6-7-14-8-15(9-16-10-19(30)27(2,3)36-23(14)16)24-26(34-5)22(32)20-18(35-24)11-17(29)25(33-4)21(20)31/h8-9,11,13,19,28-31H,6-7,10,12H2,1-5H3
C27H32O9500.537610900
52083136

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H32O9/c1-13-18-19(34-16(4)28)24(8)14(2)26(20(30)33-15(3)27(26,32)21(31)36-24)23(18,7)11-12-25(13)10-9-17(29)35-22(25,5)6/h9-10,15,19,32H,2,11-12H2,1,3-8H3/t15-,19+,23+,24+,25+,26+,27-/m0/s1
C27H32O9500.53766900
380841

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C27H32O9/c1-13-18-19(34-16(4)28)24(8)14(2)26(20(30)33-15(3)27(26,32)21(31)36-24)23(18,7)11-12-25(13)10-9-17(29)35-22(25,5)6/h9-10,15,19,32H,2,11-12H2,1,3-8H3
C27H32O9500.53766500
10216225

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H32O9/c1-16-8-9-26-14-32-23(30)22-24(2,36-22)10-11-31-20(28)6-4-5-7-21(29)35-17-13-19(34-18(26)12-16)27(15-33-27)25(17,26)3/h4-7,12,17-19,22H,8-11,13-15H2,1-3H3/b6-4+,7-5-/t17-,18-,19-,22-,24-,25-,26-,27+/m1/s1
C27H32O9500.53766704
4585390

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C27H32O9/c1-16-8-9-32-22(29)6-4-5-7-23(30)36-19-12-21-27(15-34-27)25(19,3)26(14-33-24(31)10-16)13-18(28)17(2)11-20(26)35-21/h4-7,10-11,18-21,28H,8-9,12-15H2,1-3H3/b6-4-,7-5-,16-10-
C27H32O9500.53765500
10274906

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H32O9/c1-16-8-9-32-22(29)6-4-5-7-23(30)36-19-12-21-27(15-34-27)25(19,3)26(14-33-24(31)10-16)13-18(28)17(2)11-20(26)35-21/h4-7,10-11,18-21,28H,8-9,12-15H2,1-3H3/b6-4+,7-5-,16-10+/t18-,19+,20+,21+,25+,26+,27-/m0/s1
C27H32O9500.53764500
28710701
InChI=1/C27H32O9/c1-28-15-10-17(30-3)23(18(11-15)31-4)25-21(34-7)14-22(35-8)26(27(25)36-9)24-19(32-5)12-16(29-2)13-20(24)33-6/h10-14H,1-9H3
C27H32O9500.53764300
4945354

Double-bond stereo

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C27H32O9/c1-7-13(2)21-25(6)19-11-9-16-12-17(22(30)31)8-10-18(16)24(19,5)27(35-21,36-25)26(34-15(4)28)20(29)14(3)33-23(26)32/h7,9,11,16-19,21H,3,8,10,12H2,1-2,4-6H3,(H,30,31)/b13-7+/t16-,17-,18-,19-,21+,24+,25-,26+,27?/m0/s1
C27H32O9500.53764400
8824408

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H32O9/c1-15-10-11-20(33-16(2)28)26(5)21(34-23(29)18-8-6-12-31-18)14-17-22(27(15,26)36-25(17,3)4)35-24(30)19-9-7-13-32-19/h6-9,12-13,15,17,20-22H,10-11,14H2,1-5H3/t15-,17-,20+,21+,22-,26+,27-/m1/s1
C27H32O9500.53764300
10194021

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H32O9/c1-15-6-7-20(33-16(2)28)26(5)21(34-23(29)17-8-10-31-13-17)12-19-22(27(15,26)36-25(19,3)4)35-24(30)18-9-11-32-14-18/h8-11,13-15,19-22H,6-7,12H2,1-5H3/t15-,19-,20+,21+,22-,26+,27-/m1/s1
C27H32O9500.53764501
103748926

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C27H32O9/c1-13(2)26(28)36-25-16-11-17(30-5)21(31-6)24(33-8)20(16)19-15(9-14(3)27(25,4)29)10-18-22(23(19)32-7)35-12-34-18/h10-11,14,25,29H,1,9,12H2,2-8H3/t14-,25-,27-/m0/s1
C27H32O9500.53763200
23116745
InChI=1/C27H32O9/c1-6-30-18-14-21(35-16-23(28)33-9-4)24-22(15-18)36-26(27(25(24)29)34-10-5)17-11-12-19(31-7-2)20(13-17)32-8-3/h11-15H,6-10,16H2,1-5H3
C27H32O9500.53763300
28502794

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H32O9/c1-14(28)35-19-12-17(24(31)34-5)26(2)11-10-16-25(32)36-20(13-27(16,3)23(26)22(19)30)21(29)15-8-6-7-9-18(15)33-4/h6-9,16-17,19-20,23H,10-13H2,1-5H3/t16-,17-,19-,20-,23-,26-,27-/m0/s1
C27H32O9500.53763300
28502795

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H32O9/c1-14(28)35-19-12-18(24(31)34-5)26(2)10-9-17-25(32)36-20(13-27(17,3)23(26)22(19)30)21(29)15-7-6-8-16(11-15)33-4/h6-8,11,17-20,23H,9-10,12-13H2,1-5H3/t17-,18-,19-,20-,23-,26-,27-/m0/s1
C27H32O9500.53763300
28502796

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H32O9/c1-14(28)35-19-12-18(24(31)34-5)26(2)11-10-17-25(32)36-20(13-27(17,3)23(26)22(19)30)21(29)15-6-8-16(33-4)9-7-15/h6-9,17-20,23H,10-13H2,1-5H3/t17-,18-,19-,20-,23-,26-,27-/m0/s1
C27H32O9500.53763300
4585430

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C27H32O9/c1-17-7-9-26-15-33-24(31)12-18(14-28)8-10-32-22(29)5-3-4-6-23(30)36-19-13-21(35-20(26)11-17)27(16-34-27)25(19,26)2/h3-6,11-12,19-21,28H,7-10,13-16H2,1-2H3/b5-3-,6-4-,18-12+
C27H32O9500.53763400
290582

0 of 12 defined stereocentres - 0/12 defined
InChI=1/C27H32O9/c1-12-9-16(28)21(30)25(3)15(12)10-17-26-11-34-27(33,24(25)26)20(29)13(2)18(26)19(23(32)35-17)36-22(31)14-7-5-4-6-8-14/h4-8,12-13,15,17-21,24,29-30,33H,9-11H2,1-3H3
C27H32O9500.53763200
12345

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