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: BQNOZWXAYRTLFO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17465498

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C27H32O5/c1-18-12-13-19(2)22(14-18)17-31-24-15-21-9-5-4-6-10-23(28)11-7-8-20(3)32-27(30)26(21)25(29)16-24/h5,9,12-16,20,29H,4,6-8,10-11,17H2,1-3H3/b9-5+/t20-/m0/s1
C27H32O5436.5412700
2639560

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H32O5/c1-18-12-13-19(2)22(14-18)17-31-24-15-21-9-5-4-6-10-23(28)11-7-8-20(3)32-27(30)26(21)25(29)16-24/h5,9,12-16,20,29H,4,6-8,10-11,17H2,1-3H3
C27H32O5436.542100
64866650

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C27H32O5/c1-18-12-13-19(2)22(14-18)17-31-24-15-21-9-5-4-6-10-23(28)11-7-8-20(3)32-27(30)26(21)25(29)16-24/h5,9,12-16,20,29H,4,6-8,10-11,17H2,1-3H3/b9-5-/t20-/m0/s1
C27H32O5436.542200
35312382

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C27H32O5/c1-18-12-13-19(2)22(14-18)17-31-24-15-21-9-5-4-6-10-23(28)11-7-8-20(3)32-27(30)26(21)25(29)16-24/h5,9,12-16,20,29H,4,6-8,10-11,17H2,1-3H3/t20-/m0/s1
C27H32O5436.541100

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