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: AHGBXGUKDIOFOR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
28718753

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C42H81NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h23-24,35,37,40-41,44-45H,3-22,25-34,36,38-39H2,1-2H3,(H,43,46)
C42H81NO3648.09742100
95750607

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C42H81NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h23-24,35,37,40-41,44-45H,3-22,25-34,36,38-39H2,1-2H3,(H,43,46)/b24-23+,37-35u
C42H81NO3648.09742300
57519102

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C42H81NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h23-24,35,37,40-41,44-45H,3-22,25-34,36,38-39H2,1-2H3,(H,43,46)/b24-23+,37-35+
C42H81NO3648.09741100
95750606

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C42H81NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h23-24,35,37,40-41,44-45H,3-22,25-34,36,38-39H2,1-2H3,(H,43,46)/b24-23-,37-35+
C42H81NO3648.09741100

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