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 15 results

Search term: VVSMJVQHDZUPIL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
7973995

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15-,16-,19-,20-,21-/m0/s1
C21H28O4344.4446403400
20002866

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14?,15-,16-,19-,20-,21-/m0/s1
C21H28O4344.4446231122
248225

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3
C21H28O4344.4446161300
2035064

3 of 6 defined stereocentres - 3/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15?,16?,19?,20-,21-/m0/s1
C21H28O4344.4446213600
10062447

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15+,16+,19-,20-,21-/m0/s1
C21H28O4344.44463200
21503935

1 of 6 defined stereocentres - 1/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15?,16?,19?,20?,21?/m0/s1
C21H28O4344.44463200
10062449

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15-,16+,19-,20-,21-/m0/s1
C21H28O4344.44463200
10062448

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15+,16-,19-,20-,21-/m0/s1
C21H28O4344.44462100
8307786

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15-,16?,19-,20-,21-/m0/s1
C21H28O4344.44462100
9705076

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15+,16+,19+,20+,21+/m1/s1
C21H28O4344.44462100
10061245

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15-,16-,19+,20+,21-/m1/s1
C21H28O4344.44462100
10061246

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15+,16+,19-,20-,21+/m0/s1
C21H28O4344.44462100
10061247

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15-,16-,19+,20-,21-/m1/s1
C21H28O4344.44462100
10061248

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15+,16+,19-,20+,21+/m0/s1
C21H28O4344.44462100
113608221

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H28O4/c1-12(22)25-14-6-8-20(2)13(10-14)11-17(23)19-15-4-5-18(24)21(15,3)9-7-16(19)20/h11,14-16,19H,4-10H2,1-3H3/t14-,15-,16-,19-,20-,21-/m1/s1
C21H28O4344.44461100

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