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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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Single/Multi-component
Isotopically Labeled
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Found 365 results

Search term: C25H38O5 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
49179


7 of 7 defined stereocentres - 7/7 defined
InChI=1/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1
C25H38O5418.5662152247523548
10039797

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19-,20-,21-,23-/m1/s1
C25H38O5418.5662282000
10128437

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H38O5/c1-14(26)20-8-9-21-19-7-6-17-12-18(29-15(2)27)10-11-24(17,4)22(19)13-23(25(20,21)5)30-16(3)28/h17-23H,6-13H2,1-5H3/t17-,18-,19+,20-,21+,22+,23+,24+,25-/m1/s1
C25H38O5418.5662231900
92490

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C25H38O5/c1-21-10-11-24(29-14-15-30-24)16-17(21)4-5-18-19(21)6-8-22(2)20(18)7-9-25(22,26)23(3)27-12-13-28-23/h4,18-20,26H,5-16H2,1-3H3/t18-,19+,20+,21+,22+,25-/m1/s1
C25H38O5418.5662181800
3866078

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3
C25H38O5418.566217600900
44208946

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H38O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-19,23,26H,5-13H2,1-4H3/t14-,15+,16-,17-,18+,19+,23+,24+,25-/m1/s1
C25H38O5418.5662171600
4948198

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C25H38O5/c1-18-7-5-12-24(2,3)21(18)11-14-25(4,29)13-6-8-19(16-26)9-10-22-20(17-27)15-23(28)30-22/h6,9,13,15,22,26-27,29H,5,7-8,10-12,14,16-17H2,1-4H3/b13-6+,19-9-
C25H38O5418.5662161400
4925517

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19?,20-,21-,23-/m0/s1
C25H38O5418.5662141100
24535031

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23?/m0/s1
C25H38O5418.5662141200
8223208

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C25H38O5/c1-17(8-10-21-18(2)22(28)12-13-25(21,3)4)6-5-7-19(15-26)9-11-23-20(16-27)14-24(29)30-23/h6,9,14,22-23,26-28H,5,7-8,10-13,15-16H2,1-4H3/b17-6+,19-9-
C25H38O5418.5662111000
4451314

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C25H38O5/c1-15(26)19-6-7-20-18-5-4-16-14-17(30-23(29)9-8-22(27)28)10-12-24(16,2)21(18)11-13-25(19,20)3/h16-21H,4-14H2,1-3H3,(H,27,28)/t16-,17-,18-,19+,20-,21-,24-,25+/m0/s1
C25H38O5418.56622101000
10050818

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H38O5/c1-14(29-15(2)26)20-8-9-21-19-7-6-17-12-18(30-16(3)27)10-11-24(17,4)23(19)22(28)13-25(20,21)5/h14,17-21,23H,6-13H2,1-5H3/t14-,17+,18+,19-,20+,21-,23+,24-,25+/m0/s1
C25H38O5418.566210600
21332681

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C25H36O4.H2O/c26-20-18(9-7-15-24(20)22(28-24)11-3-1-4-12-22)17-19-10-8-16-25(21(19)27)23(29-25)13-5-2-6-14-23;/h18-19H,1-17H2;1H2/t18-,19-,24+,25+;/m1./s1
C25H38O5418.56628300
216865

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C25H38O5/c1-14(26)20-8-9-21-19-7-6-17-12-18(29-15(2)27)10-11-24(17,4)22(19)13-23(25(20,21)5)30-16(3)28/h17-23H,6-13H2,1-5H3
C25H38O5418.56628700
486971

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C25H38O5/c1-22-8-9-25(29-12-13-30-25)14-16(22)4-5-17-18-6-7-20(24(3)27-10-11-28-24)23(18,2)15-19(26)21(17)22/h16-18,20-21H,4-15H2,1-3H3
C25H38O5418.56627600
558823

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C25H38O5/c1-18(2)16-22(27)29-20-11-15-24(5,13-7-12-23(3,4)28)14-10-19(17-26)8-9-21-25(20,6)30-21/h7,10-12,15-16,20-21,26,28H,8-9,13-14,17H2,1-6H3/b12-7+,15-11+,19-10+/t20-,21+,24+,25+/m1/s1
C25H38O5418.56627600
2035118

5 of 8 defined stereocentres - 5/8 defined
InChI=1/C25H38O5/c1-15(26)29-18-10-12-23(3)17(14-18)6-7-19-20(23)11-13-24(4)21(19)8-9-22(28)25(24,5)30-16(2)27/h17-21H,6-14H2,1-5H3/t17-,18-,19?,20?,21?,23-,24-,25+/m0/s1
C25H38O5418.566227400
8868694

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H38O5/c1-22(2)8-6-9-23(3)14(22)7-10-24(4)15(23)12-17(27)25(5)16(24)11-13(26)18-19(25)21(29)30-20(18)28/h13-17,21,26-27,29H,6-12H2,1-5H3/t13-,14+,15-,16+,17-,21-,23+,24-,25-/m1/s1
C25H38O5418.56627600
9445071

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C25H38O5/c1-18(11-7-13-21-17-23(28)30-24(21)29)9-6-10-19(2)14-15-22(27)25(4,5)16-8-12-20(3)26/h10-11,17,24,29H,6-9,12-16H2,1-5H3/b18-11+,19-10+
C25H38O5418.56627600
9502512

Double-bond stereo

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C25H38O5/c1-17(10-7-11-20-16-22(28)30-23(20)29)8-6-9-18(2)12-15-25(19(3)26)21(27)13-14-24(25,4)5/h9-10,16,21,23,27,29H,6-8,11-15H2,1-5H3/b17-10+,18-9+/t21-,23?,25-/m1/s1
C25H38O5418.56627600
12345

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