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 4 results

Search term: HUAKBQRUWMYNSD (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4425157

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C21H32O5/c1-5-19-17(13-22)8-6-7-9-18(23)15(3)12-16(4)21(25)14(2)10-11-20(24)26-19/h6-11,14-17,19,21-22,25H,5,12-13H2,1-4H3
C21H32O5364.475782100
4947997

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H32O5/c1-5-19-17(13-22)8-6-7-9-18(23)15(3)12-16(4)21(25)14(2)10-11-20(24)26-19/h6-11,14-17,19,21-22,25H,5,12-13H2,1-4H3/b8-6-,9-7-,11-10+/t14-,15+,16-,17+,19+,21-/m0/s1
C21H32O5364.47582200
57523010

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H32O5/c1-5-19-17(13-22)8-6-7-9-18(23)15(3)12-16(4)21(25)14(2)10-11-20(24)26-19/h6-11,14-17,19,21-22,25H,5,12-13H2,1-4H3/b8-6+,9-7-,11-10+/t14-,15+,16-,17+,19+,21+/m0/s1
C21H32O5364.47581100
78438568

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C21H32O5/c1-5-19-17(13-22)8-6-7-9-18(23)15(3)12-16(4)21(25)14(2)10-11-20(24)26-19/h6-11,14-17,19,21-22,25H,5,12-13H2,1-4H3/b8-6+,9-7+,11-10+/t14-,15?,16-,17+,19+,21+/m0/s1
C21H32O5364.47581100

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