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: PEBOIXSAFUPQGV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
22899850

12 of 13 defined stereocentres - 12/13 defined
InChI=1/C31H38O4/c1-13(2)34-27-25-20-12-19-15-6-7-16(10-15)21(19)24(20)26-22-17-8-9-18(11-17)23(22)30(33-5)31(25,26)29(32)28(27)35-14(3)4/h6-9,12-19,21-26,30H,10-11H2,1-5H3/t15-,16+,17+,18?,19-,21+,22+,23-,24+,25-,26+,30-,31-/m0/s1
C31H38O4474.6313400
82950869

13 of 13 defined stereocentres - 13/13 defined
InChI=1/C31H38O4/c1-13(2)34-27-25-20-12-19-15-6-7-16(10-15)21(19)24(20)26-22-17-8-9-18(11-17)23(22)30(33-5)31(25,26)29(32)28(27)35-14(3)4/h6-9,12-19,21-26,30H,10-11H2,1-5H3/t15-,16+,17+,18-,19-,21+,22+,23-,24+,25-,26+,30-,31-/m0/s1
C31H38O4474.6311100

Advertisement