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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
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Found 89 results

Search term: C29H34O10 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4475438

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C29H34O10/c1-14-17(31)12-29(36)24(38-25(35)16-9-7-6-8-10-16)22-27(5,23(34)21(33)20(14)26(29,3)4)18(32)11-19-28(22,13-37-19)39-15(2)30/h6-10,17-19,22,24,31-32,36H,11-13H2,1-5H3/t17-,18+,19+,22-,24-,27+,28-,29+/m0/s1
C29H34O10542.5743171500
24714691

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C29H34O10/c1-14-17(31)12-29(36)24(38-25(35)16-9-7-6-8-10-16)22-27(5,23(34)21(33)20(14)26(29,3)4)18(32)11-19-28(22,13-37-19)39-15(2)30/h6-10,18-19,21-22,24,32-33,36H,11-13H2,1-5H3/t18-,19+,21+,22-,24-,27+,28-,29+/m0/s1
C29H34O10542.5743141100
116775

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C29H34O10/c1-25(15-30)8-7-22(31)27(3)28(25,33)10-9-26(2)29(27,34)14-17-19(39-26)13-18(38-24(17)32)16-11-20(35-4)23(37-6)21(12-16)36-5/h7-8,11-13,30,33-34H,9-10,14-15H2,1-6H3/t25-,26+,27-,28+,29+/m1/s1
C29H34O10542.57437600
22912729

Double-bond stereo

6 of 10 defined stereocentres - 6/10 defined
InChI=1/C29H34O10/c1-16-6-8-27-14-34-23(31)11-17-10-20-28(35-13-17,24(32)25(33)39-20)7-4-3-5-22(30)38-18-12-21(37-19(27)9-16)29(15-36-29)26(18,27)2/h3-5,7,9,11,18-21,24-25,32-33H,6,8,10,12-15H2,1-2H3/b5-3-,7-4+,17-11-/t18-,19-,20?,21-,24?,25?,26-,27-,28?,29+/m1/s1
C29H34O10542.57436300
8205819

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C29H34O10/c1-25(15-30)8-7-22(31)27(3)28(25,33)10-9-26(2)29(27,34)14-17-19(39-26)13-18(38-24(17)32)16-11-20(35-4)23(37-6)21(12-16)36-5/h7-8,11-13,30,33-34H,9-10,14-15H2,1-6H3/t25-,26+,27-,28+,29+/m0/s1
C29H34O10542.57436500
8500523

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C29H34O10/c1-25(2)23-21(38-23)22(30)27(4)28(25,32)9-8-26(3)29(27,33)13-15-17(39-26)12-16(37-24(15)31)14-10-18(34-5)20(36-7)19(11-14)35-6/h10-12,21,23,32-33H,8-9,13H2,1-7H3/t21-,23-,26-,27+,28-,29-/m1/s1
C29H34O10542.57435400
9278662

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H34O10/c1-32-27-24(37-26(31)20-14-8-5-9-15-20)23-22(21(36-27)18-35-25(30)19-12-6-4-7-13-19)38-28(33-2)16-10-11-17-29(28,34-3)39-23/h4-9,12-15,21-24,27H,10-11,16-18H2,1-3H3/t21-,22-,23+,24+,27+,28+,29+/m1/s1
C29H34O10542.57434200
9694327

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C29H34O10/c1-11-17-20-19(12(2)24(34)35-20)38-29-21(17)26(5,22(11)32)6-7-27(39-29)10-28-14(8-13(30)18(27)23(29)33)25(3,4)36-15(28)9-16(31)37-28/h12-15,18-21,30H,6-10H2,1-5H3/t12-,13-,14-,15+,18-,19+,20+,21-,26-,27-,28+,29-/m0/s1
C29H34O10542.57434300
9824332

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C29H34O10/c1-12-17-18-22(26(5,34)23(33)35-18)38-29-19(17)25(4,20(12)31)8-9-27(39-29)11-28-14(7-6-13(27)21(29)32)24(2,3)36-15(28)10-16(30)37-28/h6,12,14-15,17-19,22,34H,7-11H2,1-5H3/t12-,14-,15+,17+,18+,19-,22-,25-,26+,27-,28+,29-/m0/s1
C29H34O10542.57434300
35015150

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C29H34O10/c1-7-12(4)22(30)21-26(34)15(10-17-23(31)13(5)19(8-2)38-28(17)36)25(33)16(27(21)35)11-18-24(32)14(6)20(9-3)39-29(18)37/h12,31-35H,7-11H2,1-6H3
C29H34O10542.57434400
58791603

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C29H34O10/c1-6-34-24-12-10-21(11-13-24)14-22-8-7-9-23(15-22)26-28(37-19(4)32)29(38-20(5)33)27(36-18(3)31)25(39-26)16-35-17(2)30/h7-13,15,25-29H,6,14,16H2,1-5H3/t25-,26+,27-,28+,29+/m1/s1
C29H34O10542.57433300
23291174

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C29H34O10/c1-16(30)36-23-20(37-24(32)17-10-7-6-8-11-17)15-27(4,34)29-22(31)18(26(2,3)39-29)14-21(28(23,29)5)38-25(33)19-12-9-13-35-19/h6-13,18,20-23,31,34H,14-15H2,1-5H3/t18-,20+,21+,22-,23+,27-,28-,29+/m1/s1
C29H34O10542.57433300
23328209

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C29H34O10/c1-15-10-11-26(25(3,4)34)20(15)29(35)24(33)37-13-27(29)18(31)12-19-28(14-36-19,39-16(2)30)21(27)22(26)38-23(32)17-8-6-5-7-9-17/h5-9,18-19,21-22,31,34-35H,10-14H2,1-4H3/t18-,19+,21?,22-,26-,27+,28-,29+/m0/s1
C29H34O10542.57433300
23339409

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C29H34O10/c1-25(15-30)8-7-22(31)27(3)28(25,33)10-9-26(2)29(27,34)14-17-19(39-26)13-18(38-24(17)32)16-11-20(35-4)23(37-6)21(12-16)36-5/h7-8,11-13,30,33-34H,9-10,14-15H2,1-6H3/t25-,26-,27+,28-,29-/m1/s1
C29H34O10542.57433300
24610888

Double-bond stereo

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C29H34O10/c1-15-22(39-17(3)30)14-21-20(25(15)33)12-11-19-13-18(9-7-5-6-8-10-23(31)32)24(26(34)29(19,21)4)28(37)38-16(2)27(35)36/h5-12,15,18-22,24-25,33H,2,13-14H2,1,3-4H3,(H,31,32)(H,35,36)/b6-5+,9-7+,10-8+/t15-,18+,19-,20+,21-,22+,24-,25+,29-/m0/s1
C29H34O10542.57433300
24667328

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C29H34O10/c1-13(22(32)33)10-15-19-20-25(4,23(34)26(19,5)35)8-9-27-12-28-16(24(2,3)37-17(28)11-18(30)38-28)7-6-14(27)21(31)29(20,36-15)39-27/h6,10,15-17,19-20,35H,7-9,11-12H2,1-5H3,(H,32,33)/b13-10-/t15-,16+,17-,19-,20+,25+,26-,27+,28-,29+/m1/s1
C29H34O10542.57433300
24682607

14 of 14 defined stereocentres - 14/14 defined
InChI=1/C29H34O10/c1-11-17-19-18(12(2)22(32)34-19)38-29-20(17)25(5,21(11)31)6-7-26(39-29)10-27-13(8-15-28(26,36-15)23(29)33)24(3,4)35-14(27)9-16(30)37-27/h11-15,17-20H,6-10H2,1-5H3/t11-,12-,13-,14+,15-,17+,18+,19+,20-,25-,26-,27+,28+,29-/m0/s1
C29H34O10542.57433300
10481487

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C29H34O10/c1-15-19(11-21(31)36-6)27(3,4)13-18(23(15)33)26(38-16(2)30)29(35)9-8-28(5)20(24(29)34)12-22(32)39-25(28)17-7-10-37-14-17/h7,10,12-15,19,25-26,35H,8-9,11H2,1-6H3/t15-,19-,25+,26-,28-,29-/m1/s1
C29H34O10542.57433300
10481488

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C29H34O10/c1-15-19(11-22(32)36-6)27(3,4)13-18(24(15)34)26(38-16(2)30)29(35)20-12-23(33)39-25(17-8-10-37-14-17)28(20,5)9-7-21(29)31/h8,10,12-15,19,25-26,35H,7,9,11H2,1-6H3/t15-,19-,25+,26-,28-,29+/m1/s1
C29H34O10542.57433300
22900624

Double-bond stereo

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C29H34O10/c1-6-35-28(32)22(16-24(30)34-5)25(36-17-19-12-14-21(33-4)15-13-19)26-23(38-29(2,3)39-26)18-37-27(31)20-10-8-7-9-11-20/h7-16,23,25-26H,6,17-18H2,1-5H3/b22-16-/t23-,25?,26?/m0/s1
C29H34O10542.57433300
12345

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