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 2 results

Search term: QYJCRUYMSCNVHZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
448336

7 of 10 defined stereocentres - 7/10 defined
InChI=1/C27H48O5S/c1-17(2)7-6-8-18(3)21-11-12-22-20-10-9-19-15-24(28)25(32-33(29,30)31)16-27(19,5)23(20)13-14-26(21,22)4/h17-25,28H,6-16H2,1-5H3,(H,29,30,31)/t18-,19+,20?,21-,22?,23?,24+,25+,26-,27+/m1/s1
C27H48O5S484.7322200
8588502

6 of 10 defined stereocentres - 6/10 defined
InChI=1/C27H48O5S/c1-17(2)7-6-8-18(3)21-11-12-22-20-10-9-19-15-24(28)25(32-33(29,30)31)16-27(19,5)23(20)13-14-26(21,22)4/h17-25,28H,6-16H2,1-5H3,(H,29,30,31)/t18-,19?,20?,21-,22?,23?,24+,25+,26-,27+/m1/s1
C27H48O5S484.7322100

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