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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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Isotopically Labeled
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Found 401 results

Search term: C25H37NO4 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4968

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2
C25H37NO4415.56561221095174013
4470565


Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C25H37NO4/c1-2-26-25(30)13-9-4-3-8-12-21-22(24(29)18-23(21)28)17-16-20(27)15-14-19-10-6-5-7-11-19/h3,5-8,10-11,16-17,20-24,27-29H,2,4,9,12-15,18H2,1H3,(H,26,30)/b8-3-,17-16+/t20-,21+,22+,23-,24+/m0/s1
C25H37NO4415.56568510100
4942360

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H37NO4/c1-9-18(4)22(27)19(5)15-17(3)12-10-11-16(2)13-14-21-20(6)23(28)24(29-7)25(26-21)30-8/h9-10,12-13,15,19,22,27H,11,14H2,1-8H3,(H,26,28)/b12-10+,16-13+,17-15+,18-9+/t19-,22+/m1/s1
C25H37NO4415.5656474600
5036307

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2/t25-/m0/s1
C25H37NO4415.56563632174113
26540474

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C25H37NO4/c1-20(11-12-21-9-5-4-6-10-21)30-16-8-3-2-7-15-26-18-25(29)22-13-14-24(28)23(17-22)19-27/h4-6,9-10,13-14,17,20,25-29H,2-3,7-8,11-12,15-16,18-19H2,1H3
C25H37NO4415.5656272100
5005224

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C25H37NO4/c1-2-26-25(30)13-9-4-3-8-12-21-22(24(29)18-23(21)28)17-16-20(27)15-14-19-10-6-5-7-11-19/h3,5-8,10-11,16-17,20-24,27-29H,2,4,9,12-15,18H2,1H3,(H,26,30)/b8-3+,17-16+/t20-,21+,22+,23-,24+/m0/s1
C25H37NO4415.5656251700
3189478
InChI=1/C25H37NO4/c1-6-9-10-20(27)24-19(16-25(4,5)17-21(24)28)26-14-13-18-11-12-22(29-7-2)23(15-18)30-8-3/h11-12,15,26H,6-10,13-14,16-17H2,1-5H3
C25H37NO4415.5656171200
3191831
InChI=1/C25H37NO4/c1-6-9-10-19(24-20(27)16-25(4,5)17-21(24)28)26-14-13-18-11-12-22(29-7-2)23(15-18)30-8-3/h11-12,15,26H,6-10,13-14,16-17H2,1-5H3
C25H37NO4415.5656171200
23014788

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H37NO4/c1-9-18(4)22(27)19(5)15-17(3)12-10-11-16(2)13-14-21-20(6)23(28)24(29-7)25(26-21)30-8/h9-11,13,15,19,22,27H,12,14H2,1-8H3,(H,26,28)/b11-10+,16-13+,17-15+,18-9+/t19-,22+/m0/s1
C25H37NO4415.5656151400
7987886

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2/t25-/m1/s1
C25H37NO4415.56561513174013
10627838

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C25H37NO4/c1-2-26-25(30)13-9-4-3-8-12-21-22(24(29)18-23(21)28)17-16-20(27)15-14-19-10-6-5-7-11-19/h3,5-8,10-11,16-17,20-24,27-29H,2,4,9,12-15,18H2,1H3,(H,26,30)/b8-3+,17-16+
C25H37NO4415.56561518700
35294344

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C25H37NO4/c1-2-26-25(30)13-9-4-3-8-12-21-22(24(29)18-23(21)28)17-16-20(27)15-14-19-10-6-5-7-11-19/h3,5-8,10-11,16-17,20-24,27-29H,2,4,9,12-15,18H2,1H3,(H,26,30)/b8-3-,17-16+/t20-,21-,22-,23+,24-/m1/s1
C25H37NO4415.5656141300
50645914

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C25H37NO4/c1-2-26-25(30)13-9-4-3-8-12-21-22(24(29)18-23(21)28)17-16-20(27)15-14-19-10-6-5-7-11-19/h3,5-8,10-11,16-17,20-24,27-29H,2,4,9,12-15,18H2,1H3,(H,26,30)/b8-3+,17-16u
C25H37NO4415.5656121600
17465240

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C25H37NO4/c1-17-8-11-22-24(3,13-7-14-25(22,4)23(28)29-6)20(17)10-9-19-12-15-30-21(19)16-26(5)18(2)27/h12,15,20,22H,1,7-11,13-14,16H2,2-6H3/t20-,22?,24+,25-/m0/s1
C25H37NO4415.565612900
22154995

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C25H37NO4/c1-4-29-23(28)25(13-8-11-20-9-6-5-7-10-20)14-16-26(17-15-25)22(27)21-12-18-30-24(2,3)19-21/h5-7,9-10,21H,4,8,11-19H2,1-3H3
C25H37NO4415.565610900
24747372

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C25H37NO4/c1-2-26-25(30)13-9-4-3-8-12-21-22(24(29)18-23(21)28)17-16-20(27)15-14-19-10-6-5-7-11-19/h3,5-8,10-11,16-17,20-24,27-29H,2,4,9,12-15,18H2,1H3,(H,26,30)/b8-3-,17-16+/t20?,21-,22-,23+,24+/m1/s1
C25H37NO4415.565610400
25948410

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C25H37NO4/c1-2-26-25(30)13-9-4-3-8-12-21-22(24(29)18-23(21)28)17-16-20(27)15-14-19-10-6-5-7-11-19/h3,5-8,10-11,16-17,20-24,27-29H,2,4,9,12-15,18H2,1H3,(H,26,30)/b8-3-,17-16?/t20-,21+,22+,23-,24+/m0/s1
C25H37NO4415.565610400
236251

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C25H37NO4/c1-14(27)23-21(26-9-10-26)12-20-18-6-5-16-11-17(30-15(2)28)7-8-24(16,3)19(18)13-22(29)25(20,23)4/h16-21,23H,5-13H2,1-4H3
C25H37NO4415.56569600
2096321

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C25H37NO4/c1-18(26-24(27)20-9-5-3-6-10-20)13-14-19-15-16-22(23(17-19)29-2)30-25(28)21-11-7-4-8-12-21/h15-18,20-21H,3-14H2,1-2H3,(H,26,27)
C25H37NO4415.565589700
4793770

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C25H37NO4/c1-9-18(4)22(27)19(5)15-17(3)12-10-11-16(2)13-14-21-20(6)23(28)24(29-7)25(26-21)30-8/h9-10,12-13,15,19,22,27H,11,14H2,1-8H3,(H,26,28)/b12-10+,16-13+,17-15+,18-9+
C25H37NO4415.5656910100
12345

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