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: LGRKCTFWUWAKON (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
99850

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O3/c1-3-20(23)24-19-9-8-18-17-6-4-13-12-14(22)5-7-15(13)16(17)10-11-21(18,19)2/h12,15-19H,3-11H2,1-2H3/t15-,16+,17+,18-,19-,21-/m0/s1
C21H30O3330.46115466189
475493

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C21H30O3/c1-3-20(23)24-19-9-8-18-17-6-4-13-12-14(22)5-7-15(13)16(17)10-11-21(18,19)2/h12,15-19H,3-11H2,1-2H3
C21H30O3330.46118900
82827085

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O3/c1-3-20(23)24-19-9-8-18-17-6-4-13-12-14(22)5-7-15(13)16(17)10-11-21(18,19)2/h12,15-19H,3-11H2,1-2H3/t15-,16-,17-,18+,19-,21-/m0/s1
C21H30O3330.46113600
62692168

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O3/c1-3-20(23)24-19-9-8-18-17-6-4-13-12-14(22)5-7-15(13)16(17)10-11-21(18,19)2/h12,15-19H,3-11H2,1-2H3/t15-,16+,17+,18-,19+,21+/m1/s1
C21H30O3330.46112200
111312146

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O3/c1-3-20(23)24-19-9-8-18-17-6-4-13-12-14(22)5-7-15(13)16(17)10-11-21(18,19)2/h12,15-19H,3-11H2,1-2H3/t15-,16-,17-,18+,19-,21-/m1/s1
C21H30O3330.46111100
114547224

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H30O3/c1-3-20(23)24-19-9-8-18-17-6-4-13-12-14(22)5-7-15(13)16(17)10-11-21(18,19)2/h12,15-19H,3-11H2,1-2H3/t15-,16-,17+,18-,19-,21-/m0/s1
C21H30O3330.46111100
58818125

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C21H30O3/c1-3-20(23)24-19-9-8-18-17-6-4-13-12-14(22)5-7-15(13)16(17)10-11-21(18,19)2/h12,15-19H,3-11H2,1-2H3/t15-,16+,17+,18-,19-,21?/m0/s1
C21H30O3330.46111100

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