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: DKWBQLNOCXTUPX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2111086

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C22H26O3/c23-21(14-8-2-1-3-9-14)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)20(19)22(24)25/h1-3,8-9,17-20H,4-7,10-13H2,(H,24,25)
C22H26O3338.44004161300
5031369

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H26O3/c23-21(14-8-2-1-3-9-14)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)20(19)22(24)25/h1-3,8-9,17-20H,4-7,10-13H2,(H,24,25)/t17-,18-,19-,20-/m0/s1
C22H26O3338.442100
10045506

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H26O3/c23-21(14-8-2-1-3-9-14)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)20(19)22(24)25/h1-3,8-9,17-20H,4-7,10-13H2,(H,24,25)/t17-,18+,19-,20+/m1/s1
C22H26O3338.442100
653907

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H26O3/c23-21(14-8-2-1-3-9-14)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)20(19)22(24)25/h1-3,8-9,17-20H,4-7,10-13H2,(H,24,25)/t17-,18+,19+,20+/m1/s1
C22H26O3338.442100
10045508

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H26O3/c23-21(14-8-2-1-3-9-14)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)20(19)22(24)25/h1-3,8-9,17-20H,4-7,10-13H2,(H,24,25)/t17-,18-,19+,20-/m0/s1
C22H26O3338.442100
10045507

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H26O3/c23-21(14-8-2-1-3-9-14)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)20(19)22(24)25/h1-3,8-9,17-20H,4-7,10-13H2,(H,24,25)/p-1/t17-,18-,19+,20-/m0/s1
C22H25O3337.43261100
10034250

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H26O3/c23-21(14-8-2-1-3-9-14)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)20(19)22(24)25/h1-3,8-9,17-20H,4-7,10-13H2,(H,24,25)/p-1/t17-,18+,19+,20+/m1/s1
C22H25O3337.43261100
10045505

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H26O3/c23-21(14-8-2-1-3-9-14)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)20(19)22(24)25/h1-3,8-9,17-20H,4-7,10-13H2,(H,24,25)/p-1/t17-,18+,19-,20+/m1/s1
C22H25O3337.43261100
5031368

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C22H26O3/c23-21(14-8-2-1-3-9-14)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)20(19)22(24)25/h1-3,8-9,17-20H,4-7,10-13H2,(H,24,25)/p-1/t17-,18-,19-,20-/m0/s1
C22H25O3337.43261100

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