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: SWUALYMOWVVPCX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8561075

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C25H40O3/c1-7-8-9-10-12-15-19(2)18-20(3)16-13-11-14-17-23-21(4)24(26)22(5)25(6,27)28-23/h7,10-16,20-24,26-27H,1,8-9,17-18H2,2-6H3/b12-10+,14-11+,16-13+,19-15+/t20?,21-,22+,23+,24-,25-/m0/s1
C25H40O3388.58336500
9924283

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C25H40O3/c1-7-8-9-10-12-15-19(2)18-20(3)16-13-11-14-17-23-21(4)24(26)22(5)25(6,27)28-23/h7,10-16,20-24,26-27H,1,8-9,17-18H2,2-6H3/b12-10+,14-11+,16-13+,19-15+/t20-,21-,22+,23+,24-,25-/m0/s1
C25H40O3388.58332100
10479666

Double-bond stereo

3 of 6 defined stereocentres - 3/6 defined
InChI=1/C25H40O3/c1-7-8-9-10-12-15-19(2)18-20(3)16-13-11-14-17-23-21(4)24(26)22(5)25(6,27)28-23/h7,10-16,20-24,26-27H,1,8-9,17-18H2,2-6H3/b12-10+,14-11+,16-13+,19-15+/t20-,21?,22+,23+,24?,25?/m0/s1
C25H40O3388.58332200

Advertisement