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 2 results

Search term: FGXQHTAZGUVDNJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2595807

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C44H58N4O12/c1-4-24-58-44-39(47(20-25-57-26-23-51)40(52)19-14-30-12-15-32(16-13-30)48(54)55)29-37(46-56-3)35-27-31(10-6-8-21-49)34(11-7-9-22-50)41(42(35)44)36-28-33(17-18-38(36)60-44)59-43(53)45-5-2/h4,12-19,27-28,31,34,39,41-42,49-51H,1,5-11,20-26,29H2,2-3H3,(H,45,53)
C44H58N4O12834.95092100
5068273

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C44H58N4O12/c1-4-24-58-44-39(47(20-25-57-26-23-51)40(52)19-14-30-12-15-32(16-13-30)48(54)55)29-37(46-56-3)35-27-31(10-6-8-21-49)34(11-7-9-22-50)41(42(35)44)36-28-33(17-18-38(36)60-44)59-43(53)45-5-2/h4,12-19,27-28,31,34,39,41-42,49-51H,1,5-11,20-26,29H2,2-3H3,(H,45,53)/t31-,34+,39-,41+,42+,44+/m0/s1
C44H58N4O12834.95092100

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