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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 19 results

Search term: C27H26O18 (Found by molecular formula)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
32696916

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C27H26O18/c28-9-2-1-7(3-13(9)43-27-21(36)17(32)19(34)23(45-27)25(39)40)12-6-11(30)15-10(29)4-8(5-14(15)42-12)41-26-20(35)16(31)18(33)22(44-26)24(37)38/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20+,21+,22-,23-,26+,27+/m0/s1
C27H26O18638.4845202400
4445350

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C27H26O18/c28-9-2-1-7(3-10(9)29)13-6-12(31)15-11(30)4-8(5-14(15)42-13)41-27-23(19(35)18(34)22(44-27)25(39)40)45-26-20(36)16(32)17(33)21(43-26)24(37)38/h1-6,16-23,26-30,32-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20+,21-,22-,23+,26-,27+/m0/s1
C27H26O18638.48454172000
4830046

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C27H26O18/c28-9-2-1-7(3-10(9)29)13-6-12(31)15-11(30)4-8(5-14(15)42-13)41-26-20(36)18(34)21(23(45-26)25(39)40)43-27-19(35)16(32)17(33)22(44-27)24(37)38/h1-6,16-23,26-30,32-36H,(H,37,38)(H,39,40)
C27H26O18638.48452200
58994370

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C27H26O18/c28-8-3-1-7(2-4-8)10-5-9(29)13-11(41-10)6-12(42-26-19(35)15(31)17(33)22(44-26)24(37)38)21(14(13)30)43-27-20(36)16(32)18(34)23(45-27)25(39)40/h1-6,15-20,22-23,26-28,30-36H,(H,37,38)(H,39,40)/t15-,16-,17-,18-,19+,20+,22-,23-,26+,27+/m0/s1
C27H26O18638.48452200
103885158

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C27H26O18/c28-8-3-1-7(2-4-8)10-5-9(29)13-11(41-10)6-12(14(30)15(13)31)42-27-23(19(35)18(34)22(44-27)25(39)40)45-26-20(36)16(32)17(33)21(43-26)24(37)38/h1-6,16-23,26-28,30-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20+,21-,22-,23+,26-,27+/m0/s1
C27H26O18638.48452200
113611514

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C27H26O18/c28-9-2-1-7(3-13(9)43-27-21(36)17(32)19(34)23(45-27)25(39)40)12-6-11(30)15-10(29)4-8(5-14(15)42-12)41-26-20(35)16(31)18(33)22(44-26)24(37)38/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16-,17+,18-,19+,20-,21+,22+,23+,26-,27+/m1/s1
C27H26O18638.48451100
115269533

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C27H26O18/c28-9-2-1-7(3-13(9)43-27-21(36)17(32)19(34)23(45-27)25(39)40)12-6-11(30)15-10(29)4-8(5-14(15)42-12)41-26-20(35)16(31)18(33)22(44-26)24(37)38/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16-,17-,18+,19+,20+,21+,22-,23-,26+,27+/m0/s1
C27H26O18638.48451100
115269537

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C27H26O18/c28-9-3-7(1-2-12(9)43-27-21(36)17(32)19(34)23(45-27)25(39)40)13-6-11(30)15-10(29)4-8(5-14(15)42-13)41-26-20(35)16(31)18(33)22(44-26)24(37)38/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20+,21+,22-,23-,26+,27+/m0/s1
C27H26O18638.48451100
115269539

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C27H26O18/c28-8-4-9(29)15-10(30)6-12(41-14(15)5-8)7-1-2-11(42-26-20(35)16(31)18(33)22(44-26)24(37)38)13(3-7)43-27-21(36)17(32)19(34)23(45-27)25(39)40/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20+,21+,22-,23-,26+,27+/m0/s1
C27H26O18638.48451100
115269540

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C27H26O18/c28-8-4-9(29)15-10(30)6-12(41-14(15)5-8)7-1-2-11(42-26-20(35)16(31)18(33)22(44-26)24(37)38)13(3-7)43-27-21(36)17(32)19(34)23(45-27)25(39)40/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16-,17-,18+,19+,20+,21+,22-,23-,26+,27+/m0/s1
C27H26O18638.48451100
59696156

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C27H26O18/c28-9-2-1-7(3-10(9)29)13-6-12(31)15-11(30)4-8(5-14(15)42-13)41-26-20(36)17(33)19(35)23(44-26)25(40)45-27-21(37)16(32)18(34)22(43-27)24(38)39/h1-6,16-23,26-30,32-37H,(H,38,39)/t16-,17-,18-,19-,20+,21+,22-,23-,26+,27-/m0/s1
C27H26O18638.48451100
82965815

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C27H26O18/c28-9-2-1-7(3-13(9)43-27-21(36)17(32)19(34)23(45-27)25(39)40)12-6-11(30)15-10(29)4-8(5-14(15)42-12)41-26-20(35)16(31)18(33)22(44-26)24(37)38/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20+,21+,22-,23-,26+,27+/m1/s1
C27H26O18638.48451100
103884816

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H26O18/c28-6-16-19(35)20(36)22(38)27(44-16)45-24-13(31)1-8(2-14(24)32)7-42-26(41)10-5-12(30)18(34)21(37)23(10)43-15-4-9(25(39)40)3-11(29)17(15)33/h1-5,16,19-20,22,27-38H,6-7H2,(H,39,40)/t16-,19-,20+,22-,27+/m1/s1
C27H26O18638.48451100
24843693

6 of 10 defined stereocentres - 6/10 defined
InChI=1/C27H26O18/c28-9-2-1-7(3-10(9)29)13-6-12(31)15-11(30)4-8(5-14(15)42-13)41-27-23(19(35)18(34)22(44-27)25(39)40)45-26-20(36)16(32)17(33)21(43-26)24(37)38/h1-6,16-23,26-30,32-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20?,21?,22?,23?,26-,27+/m0/s1
C27H26O18638.48451100
24843697

6 of 10 defined stereocentres - 6/10 defined
InChI=1/C27H26O18/c28-9-2-1-7(3-13(9)43-27-21(36)17(32)19(34)23(45-27)25(39)40)12-6-11(30)15-10(29)4-8(5-14(15)42-12)41-26-20(35)16(31)18(33)22(44-26)24(37)38/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20?,21?,22?,23?,26+,27+/m0/s1
C27H26O18638.48451100
24843698

6 of 10 defined stereocentres - 6/10 defined
InChI=1/C27H26O18/c28-9-2-1-7(3-13(9)43-27-21(36)17(32)19(34)23(45-27)25(39)40)12-6-11(30)15-10(29)4-8(5-14(15)42-12)41-26-20(35)16(31)18(33)22(44-26)24(37)38/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16-,17-,18+,19+,20?,21?,22?,23?,26+,27+/m0/s1
C27H26O18638.48451100
24843703

5 of 10 defined stereocentres - 5/10 defined
InChI=1/C27H26O18/c28-9-3-7(1-2-12(9)43-27-21(36)17(32)19(34)23(45-27)25(39)40)13-6-11(30)15-10(29)4-8(5-14(15)42-13)41-26-20(35)16(31)18(33)22(44-26)24(37)38/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16?,17?,18-,19-,20?,21?,22+,23?,26+,27+/m0/s1
C27H26O18638.48451100
24843707

5 of 10 defined stereocentres - 5/10 defined
InChI=1/C27H26O18/c28-8-4-9(29)15-10(30)6-12(41-14(15)5-8)7-1-2-11(42-26-20(35)16(31)18(33)22(44-26)24(37)38)13(3-7)43-27-21(36)17(32)19(34)23(45-27)25(39)40/h1-6,16-23,26-29,31-36H,(H,37,38)(H,39,40)/t16?,17-,18+,19+,20?,21?,22?,23?,26+,27+/m0/s1
C27H26O18638.48451100
24844069

6 of 10 defined stereocentres - 6/10 defined
InChI=1/C27H26O18/c28-8-3-1-7(2-4-8)10-5-9(29)13-11(41-10)6-12(14(30)15(13)31)42-27-23(19(35)18(34)22(44-27)25(39)40)45-26-20(36)16(32)17(33)21(43-26)24(37)38/h1-6,16-23,26-28,30-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20?,21?,22?,23?,26-,27+/m0/s1
C27H26O18638.48451100

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