Matches any text strings used to describe a molecule.
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 17 results

Search term: JDZBITULCWBIMC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10425586

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7+,16-14+
C22H30O4358.471281200
22871680

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7+,16-14+/t19-,20-/m1/s1
C22H30O4358.47126300
57575845

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7-,16-14-/t19-,20-/m1/s1
C22H30O4358.47125300
24678133

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7+,16-14-/t19-,20+/m1/s1
C22H30O4358.47123300
29272456

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7-,16-14-
C22H30O4358.471231500
34232606

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7+,16-14+/t19-,20+/m0/s1
C22H30O4358.47122200
34537215

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7+,16-14+/t19?,20-/m1/s1
C22H30O4358.47122200
2574483

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3
C22H30O4358.47122100
5438479

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7u,16-14+/t19-,20-/m1/s1
C22H30O4358.47122100
5973586

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7-,16-14+/t19-,20-/m0/s1
C22H30O4358.47122100
5973587

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7-,16-14+/t19-,20+/m0/s1
C22H30O4358.47122100
5973588

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7-,16-14+/t19-,20-/m1/s1
C22H30O4358.47122100
57373695

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7-,16-14-/t19-,20+/m1/s1
C22H30O4358.47122200
62533905

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7+,16-14+/t19-,20-/m0/s1
C22H30O4358.47121100
62624069

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7+,16-14-/t19-,20-/m1/s1
C22H30O4358.47121200
80795507

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/b15-7-,16-14-/t19-,20-/m0/s1
C22H30O4358.47121100
35312375

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3/t19-,20-/m1/s1
C22H30O4358.47121100

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