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 3 results

Search term: NEGSQWJLFWJSPG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4206106

Double-bond stereo
InChI=1/C40H48N2O5/c1-5-7-9-11-25-45-37-23-13-31(27-39(37)43-3)29-41-33-15-19-35(20-16-33)47-36-21-17-34(18-22-36)42-30-32-14-24-38(40(28-32)44-4)46-26-12-10-8-6-2/h13-24,27-30H,5-12,25-26H2,1-4H3/b41-29+,42-30+
C40H48N2O5636.819519999998161100
35385074

Double-bond stereo
InChI=1/C40H48N2O5/c1-5-7-9-11-25-45-37-23-13-31(27-39(37)43-3)29-41-33-15-19-35(20-16-33)47-36-21-17-34(18-22-36)42-30-32-14-24-38(40(28-32)44-4)46-26-12-10-8-6-2/h13-24,27-30H,5-12,25-26H2,1-4H3
C40H48N2O5636.81951100
62250526

Double-bond stereo
InChI=1/C40H48N2O5/c1-5-7-9-11-25-45-37-23-13-31(27-39(37)43-3)29-41-33-15-19-35(20-16-33)47-36-21-17-34(18-22-36)42-30-32-14-24-38(40(28-32)44-4)46-26-12-10-8-6-2/h13-24,27-30H,5-12,25-26H2,1-4H3/b41-29+,42-30u
C40H48N2O5636.81951100

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