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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 59 results

Search term: C34H54O7 (Found by molecular formula)
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
96992

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C34H54O7/c1-6-7-8-9-10-11-12-13-14-15-16-17-27(36)41-30-23(3)33(39)25(28-31(4,5)34(28,30)40)19-24(21-35)20-32(38)26(33)18-22(2)29(32)37/h18-19,23,25-26,28,30,35,38-40H,6-17,20-21H2,1-5H3/t23-,25+,26-,28-,30-,32-,33-,34-/m1/s1
C34H54O7574.788418483700
2386624

0 of 12 defined stereocentres - 0/12 defined
InChI=1/C34H54O7/c1-19(35)39-22-16-23-31(8)17-21(37)26(32(9)12-10-25(41-32)29(5,6)38)30(31,7)14-15-33(23)18-34(33)13-11-24(40-20(2)36)28(3,4)27(22)34/h21-27,37-38H,10-18H2,1-9H3
C34H54O7574.78835999999810500
18613404

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C34H54O7/c1-6-7-8-9-10-11-12-13-14-15-16-17-27(36)41-34-28(31(34,4)5)25-19-24(21-35)20-32(39)26(18-22(2)29(32)37)33(25,40)23(3)30(34)38/h18-19,23,25-26,28,30,35,38-40H,6-17,20-21H2,1-5H3/t23-,25+,26-,28-,30-,32-,33-,34-/m1/s1
C34H54O7574.7884108500
17467220

11 of 12 defined stereocentres - 11/12 defined
InChI=1/C34H54O7/c1-19(35)39-22-16-23-31(8)17-21(37)26(32(9)12-10-25(41-32)29(5,6)38)30(31,7)14-15-33(23)18-34(33)13-11-24(40-20(2)36)28(3,4)27(22)34/h21-27,37-38H,10-18H2,1-9H3/t21-,22-,23-,24-,25-,26-,27?,30+,31-,32+,33-,34+/m0/s1
C34H54O7574.78848300
405837

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C34H54O7/c1-20(2)21-10-15-34(29(38)39)17-16-32(6)22(28(21)34)8-9-24-31(5)13-12-25(41-27(37)19-40-18-26(35)36)30(3,4)23(31)11-14-33(24,32)7/h20-25,28H,8-19H2,1-7H3,(H,35,36)(H,38,39)/t21-,22+,23-,24+,25-,28+,31-,32+,33+,34-/m0/s1
C34H54O7574.78846500
28467721

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C34H54O7/c1-6-7-8-9-10-11-12-13-14-15-16-17-27(36)41-34-28(31(34,4)5)25-19-24(21-35)20-32(39)26(18-22(2)29(32)37)33(25,40)23(3)30(34)38/h18-19,23,25-26,28,30,35,38-40H,6-17,20-21H2,1-5H3/t23-,25+,26-,28+,30-,32-,33-,34-/m1/s1
C34H54O7574.78846300
28480288

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C34H54O7/c1-21(12-15-29-33(8,9)31(39)17-18-34(29,10)41-25(5)36)11-14-26(37)19-23(3)28(40-24(4)35)20-27-22(2)13-16-30(38)32(27,6)7/h11,13,19,26-29,31,37,39H,12,14-18,20H2,1-10H3/b21-11+,23-19+/t26-,27-,28+,29+,31+,34+/m1/s1
C34H54O7574.78846600
285917

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C34H54O7/c1-6-7-8-9-10-11-12-13-14-15-16-17-27(36)41-32-20-23(3)33(39)25(28(32)31(32,4)5)19-24(21-35)30(38)34(40)26(33)18-22(2)29(34)37/h18-19,23,25-26,28,30,35,38-40H,6-17,20-21H2,1-5H3
C34H54O7574.78846500
8206590

11 of 12 defined stereocentres - 11/12 defined
InChI=1/C34H54O7/c1-9-22(38)16-29(39)41-24-17-27-33(7)15-12-25-31(5,10-2)13-11-14-32(25,6)26(33)18-28(40-21(4)37)34(27,8)23(19-35)30(24)20(3)36/h19,22-28,30,38H,9-18H2,1-8H3/t22?,23-,24-,25-,26+,27-,28-,30-,31-,32-,33+,34+/m0/s1
C34H54O7574.78846500
9040049

16 of 16 defined stereocentres - 16/16 defined
InChI=1/C34H54O7/c1-16(2)18(4)31(7)14-24(31)17(3)23-12-25(39-19(5)35)29-22-11-28-34(41-28)13-21(37)10-27(38)33(34,9)30(22)26(40-20(6)36)15-32(23,29)8/h16-18,21-30,37-38H,10-15H2,1-9H3/t17-,18+,21-,22-,23+,24+,25-,26+,27-,28+,29+,30+,31+,32+,33+,34+/m0/s1
C34H54O7574.78845400
383063

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C34H54O7/c1-5-6-7-8-9-10-11-12-13-14-15-16-26(36)41-30-23-17-18-24-32-21-40-34(39,33(24,30)28(37)22(23)2)29(38)27(32)31(3,4)20-19-25(32)35/h23-25,27,29-30,35,38-39H,2,5-21H2,1,3-4H3
C34H54O7574.78845400
8091801

Double-bond stereo

10 of 12 defined stereocentres - 10/12 defined
InChI=1/C34H54O7/c1-10-19(4)14-33(9,38)17-28(35)41-27-16-32(8)15-24-20(5)11-12-25-22(7)40-31(37)30(36)34(25,39)21(6)23(24)13-26(32)29(27)18(2)3/h11,18-19,22-27,29-30,36,38-39H,6,10,12-17H2,1-5,7-9H3/b20-11-/t19?,22-,23+,24+,25-,26-,27+,29+,30+,32-,33?,34+/m1/s1
C34H54O7574.78845500
9278941

15 of 15 defined stereocentres - 15/15 defined
InChI=1/C34H54O7/c1-16(2)18(4)33(8)15-24(33)17(3)23-14-26(40-19(5)35)28-27-25(38)13-21-12-22(37)10-11-32(21,7)29(27)30(39)31(34(23,28)9)41-20(6)36/h13,16-18,22-31,37-39H,10-12,14-15H2,1-9H3/t17-,18+,22-,23+,24+,25+,26-,27-,28-,29+,30-,31+,32-,33+,34+/m0/s1
C34H54O7574.78845400
9299805

15 of 15 defined stereocentres - 15/15 defined
InChI=1/C34H54O7/c1-16(2)18(4)33(8)15-24(33)17(3)23-14-26(40-19(5)35)28-27-25(38)13-21-12-22(37)10-11-32(21,7)29(27)30(41-20(6)36)31(39)34(23,28)9/h13,16-18,22-31,37-39H,10-12,14-15H2,1-9H3/t17-,18+,22-,23+,24+,25+,26-,27-,28-,29+,30-,31+,32-,33+,34+/m0/s1
C34H54O7574.78845400
81422845

7 of 12 defined stereocentres - 7/12 defined
InChI=1/C34H54O7/c1-19(35)39-22-16-23-31(8)17-21(37)26(32(9)12-10-25(41-32)29(5,6)38)30(31,7)14-15-33(23)18-34(33)13-11-24(40-20(2)36)28(3,4)27(22)34/h21-27,37-38H,10-18H2,1-9H3/t21?,22-,23?,24?,25+,26?,27?,30+,31-,32-,33-,34+/m0/s1
C34H54O7574.78845400
28591044
InChI=1/C34H54O7/c1-2-3-4-5-6-7-9-12-32-15-17-34(18-16-32)41-30-29-39-26-25-37-22-21-35-19-20-36-23-24-38-27-28-40-31-33-13-10-8-11-14-33/h8,10-11,13-18H,2-7,9,12,19-31H2,1H3
C34H54O7574.78844300
9083208

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C34H54O7/c1-20(35)40-26-13-16-31(6)22(29(26,3)4)12-18-34(39)19-30(5)15-11-24-32(7,23(30)9-10-25(31)34)17-14-27(41-21(2)36)33(24,8)28(37)38/h22-27,39H,9-19H2,1-8H3,(H,37,38)/t22-,23-,24+,25+,26+,27-,30-,31-,32+,33+,34-/m0/s1
C34H54O7574.78844300
9653518

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C34H54O7/c1-20(26(40-21(2)36)18-29(31(6,7)39)41-22(3)37)23-14-15-33(9)27-12-10-24-25(11-13-28(38)30(24,4)5)32(27,8)16-17-34(23,33)19-35/h10,20,23,25-27,29,35,39H,11-19H2,1-9H3/t20-,23?,25+,26+,27+,29+,32-,33-,34-/m0/s1
C34H54O7574.78843200
10258200

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C34H54O7/c1-18(2)22-14-24(38)28-33(9)11-10-21-27(32(33,8)12-13-34(22,28)17-40-19(3)35)23(37)15-26-30(5,6)29(39)25(41-20(4)36)16-31(21,26)7/h10,18,22-29,37-39H,11-17H2,1-9H3/t22-,23-,24+,25+,26-,27-,28+,29-,31+,32-,33+,34+/m0/s1
C34H54O7574.78843300
8546335

12 of 15 defined stereocentres - 12/15 defined
InChI=1/C34H54O7/c1-16(2)18(4)33(8)15-24(33)17(3)23-14-26(40-19(5)35)28-27-25(38)13-21-12-22(37)10-11-32(21,7)29(27)30(39)31(34(23,28)9)41-20(6)36/h13,16-18,22-31,37-39H,10-12,14-15H2,1-9H3/t17-,18+,22-,23+,24+,25+,26-,27?,28?,29?,30-,31+,32-,33+,34+/m0/s1
C34H54O7574.78842100
123

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