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 9 results

Search term: AZAWTSYUQKXIGK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4516275

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H32O3/c1-17(9-7-10-18(2)12-16-24-19(3)23)11-15-22-20(4,5)13-8-14-21(22,6)25-22/h7,9-12,15H,8,13-14,16H2,1-6H3/b10-7+,15-11+,17-9+,18-12+
C22H32O3344.4877111000
77499038

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H32O3/c1-17(9-7-10-18(2)12-16-24-19(3)23)11-15-22-20(4,5)13-8-14-21(22,6)25-22/h7,9-12,15H,8,13-14,16H2,1-6H3/b10-7-,15-11+,17-9+,18-12-/t21-,22+/m1/s1
C22H32O3344.48773300
77499039

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H32O3/c1-17(9-7-10-18(2)12-16-24-19(3)23)11-15-22-20(4,5)13-8-14-21(22,6)25-22/h7,9-12,15H,8,13-14,16H2,1-6H3/b10-7+,15-11-,17-9+,18-12-/t21-,22-/m0/s1
C22H32O3344.48773400
107433676

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C22H32O3/c1-17(9-7-10-18(2)12-16-24-19(3)23)11-15-22-20(4,5)13-8-14-21(22,6)25-22/h7,9-12,15H,8,13-14,16H2,1-6H3/b10-7+,15-11+,17-9-,18-12+/i6D3,14D2
C22H27D5O3349.51852200
58785619

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C22H32O3/c1-17(9-7-10-18(2)12-16-24-19(3)23)11-15-22-20(4,5)13-8-14-21(22,6)25-22/h7,9-12,15H,8,13-14,16H2,1-6H3/b10-7+,15-11+,17-9+,18-12+/i6D3,14D2
C22H27D5O3349.51852200
58784465

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H32O3/c1-17(9-7-10-18(2)12-16-24-19(3)23)11-15-22-20(4,5)13-8-14-21(22,6)25-22/h7,9-12,15H,8,13-14,16H2,1-6H3/b10-7+,15-11+,17-9-,18-12+
C22H32O3344.48771100
107443222

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H32O3/c1-17(9-7-10-18(2)12-16-24-19(3)23)11-15-22-20(4,5)13-8-14-21(22,6)25-22/h7,9-12,15H,8,13-14,16H2,1-6H3/b10-7-,15-11u,17-9+,18-12-/t21-,22+/m1/s1
C22H32O3344.48771300
111314419

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H32O3/c1-17(9-7-10-18(2)12-16-24-19(3)23)11-15-22-20(4,5)13-8-14-21(22,6)25-22/h7,9-12,15H,8,13-14,16H2,1-6H3/b10-7+,15-11-,17-9+,18-12-/t21-,22-/m1/s1
C22H32O3344.48771100
115039779

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H32O3/c1-17(9-7-10-18(2)12-16-24-19(3)23)11-15-22-20(4,5)13-8-14-21(22,6)25-22/h7,9-12,15H,8,13-14,16H2,1-6H3/b10-7u,15-11+,17-9u,18-12+
C22H32O3344.48771100

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