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 20 results

Search term: UXYRZJKIQKRJCF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
14296

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16-,17-,18-,19-,20-/m0/s1
C20H32O2304.4669729600
535912

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3
C20H32O2304.46691611500
17460095

6 of 8 defined stereocentres - 6/8 defined
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16?,17?,18-,19-,20-/m0/s1
C20H32O2304.46699400
24589266

4 of 8 defined stereocentres - 4/8 defined
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13?,15?,16?,17?,18-,19-,20-/m0/s1
C20H32O2304.46692200
68648498

6 of 8 defined stereocentres - 6/8 defined
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12?,13?,15-,16-,17-,18-,19-,20-/m0/s1
C20H32O2304.46692100
8766095

8 of 8 defined stereocentres - 8/8 defined

Non-standard isotope
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16-,17-,18-,19-,20-/m0/s1/i1+1
C1913CH32O2305.45952200
8884923

8 of 8 defined stereocentres - 8/8 defined

Non-standard isotope
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16-,17-,18-,19-,20-/m0/s1/i1-1
C1911CH32O2303.46762200
10043982

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16+,17+,18-,19-,20-/m0/s1
C20H32O2304.46692100
10043983

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16+,17-,18-,19-,20-/m0/s1
C20H32O2304.46692100
10043984

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16-,17+,18-,19-,20-/m0/s1
C20H32O2304.46692100
397385

5 of 8 defined stereocentres - 5/8 defined

Non-standard isotope
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15?,16?,17?,18-,19-,20-/m0/s1/i1-1
C1911CH32O2303.46762200
78272754

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16-,17-,18-,19-,20-/m1/s1
C20H32O2304.46691100
107447328

7 of 8 defined stereocentres - 7/8 defined

Non-standard isotope
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13+,15+,16+,17+,18?,19+,20+/m1/s1/i7D2,18D
C20H29D3O2307.48541100
110092430

6 of 8 defined stereocentres - 6/8 defined
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16?,17?,18-,19-,20-/m1/s1
C20H32O2304.46691100
110804187

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16-,17-,18-,19+,20+/m0/s1
C20H32O2304.46691100
111312308

7 of 8 defined stereocentres - 7/8 defined

Non-standard isotope
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13+,15+,16+,17+,18?,19+,20+/m0/s1/i7D2,18D
C20H29D3O2307.48541100
114547217

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16-,17-,18-,19+,20-/m0/s1
C20H32O2304.46691100

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