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: GFHJEKRYFWDJEZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4189042

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C32H31N3O5/c1-40-25-18-16-24(17-19-25)33-31(38)29(23-12-6-3-7-13-23)35(20-22-10-4-2-5-11-22)28(36)21-34-27-15-9-8-14-26(27)30(37)32(34)39/h2-6,8-11,14-19,23,29H,7,12-13,20-21H2,1H3,(H,33,38)
C32H31N3O5537.60563999999913900
62285848

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C32H31N3O5/c1-40-25-18-16-24(17-19-25)33-31(38)29(23-12-6-3-7-13-23)35(20-22-10-4-2-5-11-22)28(36)21-34-27-15-9-8-14-26(27)30(37)32(34)39/h2-6,8-11,14-19,23,29H,7,12-13,20-21H2,1H3,(H,33,38)/t23-,29-/m0/s1
C32H31N3O5537.60562200
62643617

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C32H31N3O5/c1-40-25-18-16-24(17-19-25)33-31(38)29(23-12-6-3-7-13-23)35(20-22-10-4-2-5-11-22)28(36)21-34-27-15-9-8-14-26(27)30(37)32(34)39/h2-6,8-11,14-19,23,29H,7,12-13,20-21H2,1H3,(H,33,38)/t23-,29+/m0/s1
C32H31N3O5537.60562200

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