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 3 results

Search term: QPXLWFWDGYBBQX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4283934

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C34H38N4O8/c1-22(19-39)35-30(40)18-26-13-7-8-14-28(38-34(44)46-20-23-9-3-2-4-10-23)33(43)45-21-29(37-31(26)41)32(42)36-27-16-15-24-11-5-6-12-25(24)17-27/h2-12,15-17,22,26,28-29,39H,13-14,18-21H2,1H3,(H,35,40)(H,36,42)(H,37,41)(H,38,44)
C34H38N4O8630.6875199999982100
5040555

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C34H38N4O8/c1-22(19-39)35-30(40)18-26-13-7-8-14-28(38-34(44)46-20-23-9-3-2-4-10-23)33(43)45-21-29(37-31(26)41)32(42)36-27-16-15-24-11-5-6-12-25(24)17-27/h2-12,15-17,22,26,28-29,39H,13-14,18-21H2,1H3,(H,35,40)(H,36,42)(H,37,41)(H,38,44)/t22-,26-,28-,29+/m1/s1
C34H38N4O8630.68752100
5040559

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C34H38N4O8/c1-22(19-39)35-30(40)18-26-13-7-8-14-28(38-34(44)46-20-23-9-3-2-4-10-23)33(43)45-21-29(37-31(26)41)32(42)36-27-16-15-24-11-5-6-12-25(24)17-27/h2-12,15-17,22,26,28-29,39H,13-14,18-21H2,1H3,(H,35,40)(H,36,42)(H,37,41)(H,38,44)/t22-,26+,28+,29-/m0/s1
C34H38N4O8630.68752100

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