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: IWXGRDWGOJXZGA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4483830

Double-bond stereo

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C29H44O6/c1-20(2)10-8-16-29(7,34)27(35-23(5)30)13-12-21(3)11-9-15-28(6,33)17-14-24-19-25(31)22(4)18-26(24)32/h10-11,14,17-19,27,31-34H,8-9,12-13,15-16H2,1-7H3/b17-14-,21-11+/t27-,28?,29+/m1/s1
C29H44O6488.65615400
23339249

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C29H44O6/c1-20(2)10-8-16-29(7,34)27(35-23(5)30)13-12-21(3)11-9-15-28(6,33)17-14-24-19-25(31)22(4)18-26(24)32/h10-11,14,17-19,27,31-34H,8-9,12-13,15-16H2,1-7H3/b17-14-,21-11+/t27-,28+,29+/m1/s1
C29H44O6488.65612200
13082674

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C29H44O6/c1-20(2)10-8-16-29(7,34)27(35-23(5)30)13-12-21(3)11-9-15-28(6,33)17-14-24-19-25(31)22(4)18-26(24)32/h10-11,14,17-19,27,31-34H,8-9,12-13,15-16H2,1-7H3/b17-14+,21-11+/t27-,28+,29+/m1/s1
C29H44O6488.65611100

Advertisement