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: MTYMFIWYWSHNSU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24649071

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C31H52O3/c1-19(2)16-21(32)17-20(3)22-12-13-31(8)27-25(34-9)18-24-23(10-11-26(33)28(24,4)5)29(27,6)14-15-30(22,31)7/h16,18,20-23,25-27,32-33H,10-15,17H2,1-9H3/t20-,21+,22-,23-,25+,26+,27-,29+,30-,31+/m1/s1
C31H52O3472.74282200
17251998

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C31H52O3/c1-19(2)16-21(32)17-20(3)22-12-13-31(8)27-25(34-9)18-24-23(10-11-26(33)28(24,4)5)29(27,6)14-15-30(22,31)7/h16,18,20-23,25-27,32-33H,10-15,17H2,1-9H3/t20-,21?,22-,23-,25+,26+,27-,29+,30-,31+/m1/s1
C31H52O3472.74281100

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