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 5 results

Search term: JRHSHBMAWLBQTD (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10282600

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H32O4/c1-15-8-6-9-16(2)12-13-19(22(4,5)26-17(3)23)20-14-18(11-7-10-15)21(24)25-20/h9-10,14,19-20H,6-8,11-13H2,1-5H3/b15-10+,16-9+/t19-,20-/m0/s1
C22H32O4360.48713311
10477857

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C22H32O4/c1-15-8-6-9-16(2)12-13-19(22(4,5)26-17(3)23)20-14-18(11-7-10-15)21(24)25-20/h9-10,14,19-20H,6-8,11-13H2,1-5H3/b15-10+,16-9+/t19?,20-/m0/s1
C22H32O4360.48712200
8514047

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H32O4/c1-15-8-6-9-16(2)12-13-19(22(4,5)26-17(3)23)20-14-18(11-7-10-15)21(24)25-20/h9-10,14,19-20H,6-8,11-13H2,1-5H3/b15-10-,16-9+/t19-,20-/m0/s1
C22H32O4360.48712100
8721847

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H32O4/c1-15-8-6-9-16(2)12-13-19(22(4,5)26-17(3)23)20-14-18(11-7-10-15)21(24)25-20/h9-10,14,19-20H,6-8,11-13H2,1-5H3/b15-10-,16-9-/t19-,20-/m0/s1
C22H32O4360.48712100
58134270

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C22H32O4/c1-15-8-6-9-16(2)12-13-19(22(4,5)26-17(3)23)20-14-18(11-7-10-15)21(24)25-20/h9-10,14,19-20H,6-8,11-13H2,1-5H3/b15-10-,16-9-/t19?,20-/m0/s1
C22H32O4360.48711100

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