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
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Found 5 results

Search term: LOHBBIJNKKFBPB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4196082

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C27H29N3O2/c1-3-30(4-2)20-13-11-18(12-14-20)27-26-23(28-21-8-5-6-9-22(21)29-27)16-19(17-24(26)31)25-10-7-15-32-25/h5-15,19,27-29H,3-4,16-17H2,1-2H3
C27H29N3O2427.53806231500
873895

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H29N3O2/c1-3-30(4-2)20-13-11-18(12-14-20)27-26-23(28-21-8-5-6-9-22(21)29-27)16-19(17-24(26)31)25-10-7-15-32-25/h5-15,19,27-29H,3-4,16-17H2,1-2H3/t19-,27+/m1/s1
C27H29N3O2427.53812100
873897

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H29N3O2/c1-3-30(4-2)20-13-11-18(12-14-20)27-26-23(28-21-8-5-6-9-22(21)29-27)16-19(17-24(26)31)25-10-7-15-32-25/h5-15,19,27-29H,3-4,16-17H2,1-2H3/t19-,27-/m1/s1
C27H29N3O2427.53812100
873898

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H29N3O2/c1-3-30(4-2)20-13-11-18(12-14-20)27-26-23(28-21-8-5-6-9-22(21)29-27)16-19(17-24(26)31)25-10-7-15-32-25/h5-15,19,27-29H,3-4,16-17H2,1-2H3/t19-,27-/m0/s1
C27H29N3O2427.53812100
873900

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H29N3O2/c1-3-30(4-2)20-13-11-18(12-14-20)27-26-23(28-21-8-5-6-9-22(21)29-27)16-19(17-24(26)31)25-10-7-15-32-25/h5-15,19,27-29H,3-4,16-17H2,1-2H3/t19-,27+/m0/s1
C27H29N3O2427.53812100

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