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
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Found 7 results

Search term: LOWIKMYPLIPDBI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4943402

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H30O4/c22-19(14-5-2-1-3-6-14)11-10-17-18-13-15(7-4-8-21(24)25)16(18)9-12-20(17)23/h7,14,16-20,22-23H,1-6,8-9,12-13H2,(H,24,25)/b15-7+/t16-,17-,18-,19+,20-/m0/s1
C21H30O4346.46059900
8060297

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H30O4/c22-19(14-5-2-1-3-6-14)11-10-17-18-13-15(7-4-8-21(24)25)16(18)9-12-20(17)23/h7,14,16-20,22-23H,1-6,8-9,12-13H2,(H,24,25)/b15-7-/t16-,17-,18+,19-,20-/m1/s1
C21H30O4346.46055300
88298478

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H30O4/c22-19(14-5-2-1-3-6-14)11-10-17-18-13-15(7-4-8-21(24)25)16(18)9-12-20(17)23/h7,14,16-20,22-23H,1-6,8-9,12-13H2,(H,24,25)/b15-7-/t16-,17-,18+,19+,20-/m0/s1
C21H30O4346.46054300
8103838

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H30O4/c22-19(14-5-2-1-3-6-14)11-10-17-18-13-15(7-4-8-21(24)25)16(18)9-12-20(17)23/h7,14,16-20,22-23H,1-6,8-9,12-13H2,(H,24,25)/b15-7-/t16-,17-,18+,19+,20-/m1/s1
C21H30O4346.46052100
8103839

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C21H30O4/c22-19(14-5-2-1-3-6-14)11-10-17-18-13-15(7-4-8-21(24)25)16(18)9-12-20(17)23/h7,14,16-20,22-23H,1-6,8-9,12-13H2,(H,24,25)/b15-7-/t16-,17?,18+,19+,20-/m0/s1
C21H30O4346.46052100
68026881

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H30O4/c22-19(14-5-2-1-3-6-14)11-10-17-18-13-15(7-4-8-21(24)25)16(18)9-12-20(17)23/h7,14,16-20,22-23H,1-6,8-9,12-13H2,(H,24,25)/b15-7+/t16-,17-,18+,19+,20-/m0/s1
C21H30O4346.46052200

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