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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 86 results

Search term: C27H29NO10 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
28163

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3/t10-,14-,16-,17-,22+,27-/m0/s1
C27H29NO10527.5199991325767281
61962
InChI=1/C27H29NO10/c1-31-20-10-16(11-21(32-2)24(20)35-5)26(29)37-14-18-8-7-9-19(28-18)15-38-27(30)17-12-22(33-3)25(36-6)23(13-17)34-4/h7-13H,14-15H2,1-6H3
C27H29NO10527.519949645237
134001

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H29NO10/c1-11-6-12(28)7-18(37-11)38-16-9-27(35,17(30)10-29)8-14-20(16)26(34)22-21(24(14)32)23(31)13-4-3-5-15(36-2)19(13)25(22)33/h3-5,11-12,16,18,29,32,34-35H,6-10,28H2,1-2H3/t11-,12+,16-,18-,27-/m0/s1
C27H29NO10527.5199211940
133560

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3/t10-,14-,16-,17-,22-,27-/m0/s1
C27H29NO10527.5199201600
2852

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3
C27H29NO10527.519919654100
21834898

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C27H29NO10/c1-6-11-34-25(32)16-7-9-17(10-8-16)36-21-14-35-20-13-18(12-19(29)22(20)23(21)30)37-24(31)15(2)28-26(33)38-27(3,4)5/h7-10,12-15,29H,6,11H2,1-5H3,(H,28,33)/t15-/m0/s1
C27H29NO10527.519914900
4745653

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H29NO10/c1-6-11-34-25(32)16-7-9-17(10-8-16)36-21-14-35-20-13-18(12-19(29)22(20)23(21)30)37-24(31)15(2)28-26(33)38-27(3,4)5/h7-10,12-15,29H,6,11H2,1-5H3,(H,28,33)
C27H29NO10527.519912700
13009700

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H29NO10/c1-13-22(15-4-7-18-20(10-15)35-9-3-8-34-18)24(31)17-6-5-16(11-19(17)36-13)37-27-23(28-14(2)30)26(33)25(32)21(12-29)38-27/h4-7,10-11,21,23,25-27,29,32-33H,3,8-9,12H2,1-2H3,(H,28,30)/t21-,23-,25-,26-,27-/m1/s1
C27H29NO10527.519912800
57578329

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H14O8.C9H15NO2/c19-15(20)13(25-17(23)11-7-3-1-4-8-11)14(16(21)22)26-18(24)12-9-5-2-6-10-12;1-9(2)5-4-10-7(6(5)9)8(11)12-3/h1-10,13-14H,(H,19,20)(H,21,22);5-7,10H,4H2,1-3H3/t13-,14-;5-,6-,7-/m00/s1
C27H29NO10527.51998500
381885

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C27H29NO10/c1-10-23(31)14(28)8-18(37-10)38-17-7-11(15(30)9-29)6-13-20(17)27(35)22-21(25(13)33)24(32)12-4-3-5-16(36-2)19(12)26(22)34/h3-5,10-11,14,17-18,23,29,31,33,35H,6-9,28H2,1-2H3
C27H29NO10527.51998600
135300

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C27H29NO10/c1-10-23(31)14(28)8-18(37-10)38-17-7-11(15(30)9-29)6-13-20(17)27(35)22-21(25(13)33)24(32)12-4-3-5-16(36-2)19(12)26(22)34/h3-5,10-11,14,17-18,23,29,31,33,35H,6-9,28H2,1-2H3/t10-,11+,14-,17-,18-,23+/m0/s1
C27H29NO10527.51998500
111478

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3/t10-,14+,16-,17-,22+,27-/m0/s1
C27H29NO10527.51997300
380312

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C27H29NO10/c1-11-6-12(28)7-18(37-11)38-16-9-27(35,17(30)10-29)8-14-20(16)26(34)22-21(24(14)32)23(31)13-4-3-5-15(36-2)19(13)25(22)33/h3-5,11-12,16,18,29,32,34-35H,6-10,28H2,1-2H3
C27H29NO10527.519979300
166644

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C27H29NO10/c1-10-22(31)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)25(34)20-21(26(13)36-3)23(32)12-5-4-6-15(30)18(12)24(20)33/h4-6,10,14,16-17,22,30-31,34-35H,7-9,28H2,1-3H3
C27H29NO10527.51996400
293341

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C27H29NO10/c1-26(35)7-9-5-10-15(20(31)14(9)13(8-26)36-4)21(32)16-12(29)6-11-23(17(16)19(10)30)37-25-22(33)18(28-3)24(34)27(11,2)38-25/h5-6,13,18,22,24-25,28-29,31,33-35H,7-8H2,1-4H3
C27H29NO10527.51996900
17339851

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3/t10-,14-,16-,17-,22+,27-/m1/s1
C27H29NO10527.51995400
152296

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C27H29NO10/c1-11-26(36-2)15(28)7-18(37-11)38-16-9-27(35,17(30)10-29)8-14-19(16)25(34)21-20(24(14)33)22(31)12-5-3-4-6-13(12)23(21)32/h3-6,11,15-16,18,26,29,33-35H,7-10,28H2,1-2H3
C27H29NO10527.51995400
130644

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C27H29NO10/c1-10-22(28)14(30)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3/t10-,14+,16?,17-,22+,27-/m0/s1
C27H29NO10527.51994300
133373

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3/t10-,14-,16-,17+,22-,27-/m0/s1
C27H29NO10527.51994300
2342071

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3/t10?,14?,16-,17?,22?,27-/m0/s1
C27H29NO10527.5198599999994200
12345

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