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 8 results

Search term: YEDABXPMRZKPMA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
115600

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C18H27FO2/c1-18-9-15(19)17-12-5-3-11(20)8-10(12)2-4-13(17)14(18)6-7-16(18)21/h10,12-17,21H,2-9H2,1H3/t10?,12-,13-,14-,15-,16-,17+,18-/m0/s1
C18H27FO2294.40426500
8555155

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C18H27FO2/c1-18-9-15(19)17-12-5-3-11(20)8-10(12)2-4-13(17)14(18)6-7-16(18)21/h10,12-17,21H,2-9H2,1H3/t10-,12-,13-,14-,15-,16-,17+,18-/m0/s1
C18H27FO2294.40424300
397424

5 of 8 defined stereocentres - 5/8 defined

Non-standard isotope
InChI=1/C18H27FO2/c1-18-9-15(19)17-12-5-3-11(20)8-10(12)2-4-13(17)14(18)6-7-16(18)21/h10,12-17,21H,2-9H2,1H3/t10-,12-,13?,14?,15-,16-,17?,18-/m0/s1/i19-1
C18H2718FO2293.40672200
8192925

5 of 8 defined stereocentres - 5/8 defined
InChI=1/C18H27FO2/c1-18-9-15(19)17-12-5-3-11(20)8-10(12)2-4-13(17)14(18)6-7-16(18)21/h10,12-17,21H,2-9H2,1H3/t10-,12-,13?,14?,15-,16-,17?,18-/m0/s1
C18H27FO2294.40422100
8215623

8 of 8 defined stereocentres - 8/8 defined

Non-standard isotope
InChI=1/C18H27FO2/c1-18-9-15(19)17-12-5-3-11(20)8-10(12)2-4-13(17)14(18)6-7-16(18)21/h10,12-17,21H,2-9H2,1H3/t10-,12-,13-,14-,15-,16-,17+,18-/m0/s1/i19-1
C18H2718FO2293.40672200
10441788

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C18H27FO2/c1-18-9-15(19)17-12-5-3-11(20)8-10(12)2-4-13(17)14(18)6-7-16(18)21/h10,12-17,21H,2-9H2,1H3
C18H27FO2294.40421100
24813401

1 of 8 defined stereocentres - 1/8 defined
InChI=1/C18H27FO2/c1-18-9-15(19)17-12-5-3-11(20)8-10(12)2-4-13(17)14(18)6-7-16(18)21/h10,12-17,21H,2-9H2,1H3/t10?,12?,13?,14?,15?,16?,17?,18-/m0/s1
C18H27FO2294.40421100
58818921

6 of 8 defined stereocentres - 6/8 defined
InChI=1/C18H27FO2/c1-18-9-15(19)17-12-5-3-11(20)8-10(12)2-4-13(17)14(18)6-7-16(18)21/h10,12-17,21H,2-9H2,1H3/t10?,12-,13-,14-,15?,16-,17+,18-/m0/s1
C18H27FO2294.40421100

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