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 5 results

Search term: RJTQRENDRIOHRF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2035899

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C21H36O4/c1-15(13-18(23)24)7-8-17-20(4)11-6-10-19(2,3)16(20)9-12-21(17,5)25-14-22/h14-17H,6-13H2,1-5H3,(H,23,24)/t15-,16?,17+,20-,21+/m0/s1
C21H36O4352.508149800
5413763

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H36O4/c1-15(13-18(23)24)7-8-17-20(4)11-6-10-19(2,3)16(20)9-12-21(17,5)25-14-22/h14-17H,6-13H2,1-5H3,(H,23,24)/t15-,16-,17+,20-,21+/m0/s1
C21H36O4352.50813200
5413761

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H36O4/c1-15(13-18(23)24)7-8-17-20(4)11-6-10-19(2,3)16(20)9-12-21(17,5)25-14-22/h14-17H,6-13H2,1-5H3,(H,23,24)/t15-,16+,17+,20-,21+/m0/s1
C21H36O4352.50812100
5413762

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H36O4/c1-15(13-18(23)24)7-8-17-20(4)11-6-10-19(2,3)16(20)9-12-21(17,5)25-14-22/h14-17H,6-13H2,1-5H3,(H,23,24)/p-1/t15-,16-,17+,20-,21+/m0/s1
C21H35O4351.50071100
5413760

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H36O4/c1-15(13-18(23)24)7-8-17-20(4)11-6-10-19(2,3)16(20)9-12-21(17,5)25-14-22/h14-17H,6-13H2,1-5H3,(H,23,24)/p-1/t15-,16+,17+,20-,21+/m0/s1
C21H35O4351.50071100

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