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: WMFMZTXHTPOWMQ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10343938

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C20H29NO6/c1-6-12(3)20(24)27-17-10-14-9-15(11-16(17)21(14)5)26-18(22)8-13(4)19(23)25-7-2/h6,14-17H,4,7-11H2,1-3,5H3/b12-6+/t14-,15-,16+,17-/m1/s1
C20H29NO6379.44743301
114545113

Double-bond stereo

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C20H29NO6/c1-6-12(3)20(24)27-17-10-14-9-15(11-16(17)21(14)5)26-18(22)8-13(4)19(23)25-7-2/h6,14-17H,4,7-11H2,1-3,5H3/b12-6+/t14?,15-,16?,17-/m1/s1
C20H29NO6379.44742200
10343937

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C20H29NO6/c1-6-12(3)20(24)27-17-10-14-9-15(11-16(17)21(14)5)26-18(22)8-13(4)19(23)25-7-2/h6,14-17H,4,7-11H2,1-3,5H3/b12-6-/t14-,15-,16+,17-/m1/s1
C20H29NO6379.44741100
113608365

Double-bond stereo

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C20H29NO6/c1-6-12(3)20(24)27-17-10-14-9-15(11-16(17)21(14)5)26-18(22)8-13(4)19(23)25-7-2/h6,14-17H,4,7-11H2,1-3,5H3/t14?,15-,16?,17+/m0/s1
C20H29NO6379.44741100

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