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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 78 results

Search term: C28H37NO9 (Found by molecular formula)
1234
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2036952
InChI=1/C28H37NO9/c30-27(31)9-11-33-13-15-35-17-19-37-20-18-36-16-14-34-12-10-29-28(32)38-21-26-24-7-3-1-5-22(24)23-6-2-4-8-25(23)26/h1-8,26H,9-21H2,(H,29,32)(H,30,31)
C28H37NO9531.59468676500
243230

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C28H37NO9/c1-26(2,32)8-9-28(33,15-22(30)35-4)25(31)38-24-21(34-3)14-27-7-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,32-33H,5-11,15-16H2,1-4H3/t23-,24-,27+,28-/m1/s1
C28H37NO9531.5947537700
3443

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C28H37NO9/c1-26(2,32)8-9-28(33,15-22(30)35-4)25(31)38-24-21(34-3)14-27-7-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,32-33H,5-11,15-16H2,1-4H3
C28H37NO9531.59472811700
66182

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C28H37NO9/c1-16(2)6-9-28(33,24(30)25(31)35-4)26(32)38-23-21(34-3)14-27-8-5-10-29(27)11-7-17-12-19-20(37-15-36-19)13-18(17)22(23)27/h12-14,16,22-24,30,33H,5-11,15H2,1-4H3/t22-,23-,24-,27+,28-/m1/s1
C28H37NO9531.5947171000
21468825

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C28H37NO9/c1-26(2,32)8-9-28(33,15-22(30)35-4)25(31)38-24-21(34-3)14-27-7-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,32-33H,5-11,15-16H2,1-4H3/t23?,24-,27+,28?/m0/s1
C28H37NO9531.5947172000
23976550

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C28H37NO9/c1-26(2,33)7-4-9-28(34,15-22(30)31)25(32)38-24-21(35-3)14-27-8-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,33-34H,4-11,15-16H2,1-3H3,(H,30,31)/t23-,24-,27+,28-/m1/s1
C28H37NO9531.594714800
65275

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C28H37NO9/c1-26(2,32)8-9-28(33,15-22(30)35-4)25(31)38-24-21(34-3)14-27-7-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,32-33H,5-11,15-16H2,1-4H3/t23-,24+,27-,28-/m0/s1
C28H37NO9531.594711800
23089589

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C28H37NO9/c1-26(2,32)8-9-28(33,15-22(30)35-4)25(31)38-24-21(34-3)14-27-7-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,32-33H,5-11,15-16H2,1-4H3/t23-,24-,27+,28+/m1/s1
C28H37NO9531.59478713525
8405740

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C28H37NO9/c1-26(2,33)7-4-9-28(34,15-22(30)31)25(32)38-24-21(35-3)14-27-8-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,33-34H,4-11,15-16H2,1-3H3,(H,30,31)
C28H37NO9531.594781000
17467426

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C28H37NO9/c1-15(25(35)36)29-22(33)6-7-23(34)38-14-21(32)28(37)11-9-19-18-5-4-16-12-17(30)8-10-26(16,2)24(18)20(31)13-27(19,28)3/h12,15,18-19,24,37H,4-11,13-14H2,1-3H3,(H,29,33)(H,35,36)/t15?,18-,19-,24+,26-,27-,28-/m0/s1
C28H37NO9531.59478400
17468588

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C28H37NO9/c1-15(25(35)36)29-22(33)6-7-23(34)38-14-21(32)28(37)11-9-19-18-5-4-16-12-17(30)8-10-26(16,2)24(18)20(31)13-27(19,28)3/h8,10,12,15,18-20,24,31,37H,4-7,9,11,13-14H2,1-3H3,(H,29,33)(H,35,36)/t15?,18-,19-,20-,24+,26-,27-,28-/m0/s1
C28H37NO9531.59477400
544571

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C28H37NO9/c1-16(2)6-9-28(33,24(30)25(31)35-4)26(32)38-23-21(34-3)14-27-8-5-10-29(27)11-7-17-12-19-20(37-15-36-19)13-18(17)22(23)27/h12-14,16,22-24,30,33H,5-11,15H2,1-4H3
C28H37NO9531.594771500
57619646

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C28H37NO9/c1-26(2,32)8-9-28(33,15-22(30)35-4)25(31)38-24-21(34-3)14-27-7-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,32-33H,5-11,15-16H2,1-4H3/t23-,24-,27+,28?/m1/s1
C28H37NO9531.59477700
4944700

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C28H37NO9/c1-4-16(2)27(34)38-22-14-29-13-5-6-21(29)20(22)15-35-23(30)12-9-18-7-10-19(11-8-18)37-28-26(33)25(32)24(31)17(3)36-28/h4,7-12,17,20-22,24-26,28,31-33H,5-6,13-15H2,1-3H3/b12-9+,16-4+/t17-,20+,21-,22-,24-,25+,26+,28-/m0/s1
C28H37NO9531.59474300
8160100

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C28H37NO9/c1-16(2)6-8-27(32,12-22(30)33-3)25(31)37-24-23-18-11-20-19(35-15-36-20)10-17(18)21-13-29-9-5-7-26(23,29)14-28(24,34-4)38-21/h10-11,16,21,23-24,32H,5-9,12-15H2,1-4H3/t21-,23-,24+,26+,27-,28+/m1/s1
C28H37NO9531.59474300
111228

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C28H37NO9/c1-26(2,32)8-9-28(33,15-22(30)35-4)25(31)38-24-21(34-3)14-27-7-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,32-33H,5-11,15-16H2,1-4H3/t23-,24-,27?,28?/m1/s1
C28H37NO9531.59474300
17470128

6 of 9 defined stereocentres - 6/9 defined
InChI=1/C28H37NO9/c1-16-10-11-20-17(2)25(35-26-28(20)19(16)14-15-27(3,36-26)37-38-28)34-22(31)13-12-21(30)29-23(24(32)33-4)18-8-6-5-7-9-18/h5-9,16-17,19-20,23,25-26H,10-15H2,1-4H3,(H,29,30)/t16-,17-,19+,20+,23?,25-,26-,27?,28?/m1/s1
C28H37NO9531.59474100
17468151

6 of 9 defined stereocentres - 6/9 defined
InChI=1/C28H37NO9/c1-16-9-10-20-17(2)25(35-26-28(20)19(16)13-14-27(3,36-26)37-38-28)34-23(31)12-11-22(30)29-21(24(32)33)15-18-7-5-4-6-8-18/h4-8,16-17,19-21,25-26H,9-15H2,1-3H3,(H,29,30)(H,32,33)/t16-,17-,19+,20+,21?,25-,26-,27?,28?/m1/s1
C28H37NO9531.59474100
23548733

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C28H37NO9/c1-16-9-10-20-17(2)25(35-26-28(20)19(16)13-14-27(3,36-26)37-38-28)34-23(31)12-11-22(30)29-21(24(32)33)15-18-7-5-4-6-8-18/h4-8,16-17,19-21,25-26H,9-15H2,1-3H3,(H,29,30)(H,32,33)/t16-,17-,19+,20+,21?,25-,26-,27+,28?/m1/s1
C28H37NO9531.59474300
23548754

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C28H37NO9/c1-16-10-11-20-17(2)25(35-26-28(20)19(16)14-15-27(3,36-26)37-38-28)34-22(31)13-12-21(30)29-23(24(32)33-4)18-8-6-5-7-9-18/h5-9,16-17,19-20,23,25-26H,10-15H2,1-4H3,(H,29,30)/t16-,17-,19+,20+,23?,25-,26-,27+,28?/m1/s1
C28H37NO9531.59474300
1234

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