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
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Found 6 results

Search term: ZQUKJJYESYKDCV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17461798

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C23H35NO3/c1-21-8-5-14(25)11-13(21)3-4-18-17(21)6-9-22(2)16-7-10-23(18,22)27-20-15(16)12-19(26)24-20/h13-18,20,25H,3-12H2,1-2H3,(H,24,26)/t13-,14+,15?,16?,17-,18+,20-,21-,22+,23-/m0/s1
C23H35NO3373.528910600
62531919

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C23H35NO3/c1-21-8-5-14(25)11-13(21)3-4-18-17(21)6-9-22(2)16-7-10-23(18,22)27-20-15(16)12-19(26)24-20/h13-18,20,25H,3-12H2,1-2H3,(H,24,26)/t13-,14-,15+,16+,17-,18+,20+,21-,22+,23-/m1/s1
C23H35NO3373.52892200
2900093

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C23H35NO3/c1-21-8-5-14(25)11-13(21)3-4-18-17(21)6-9-22(2)16-7-10-23(18,22)27-20-15(16)12-19(26)24-20/h13-18,20,25H,3-12H2,1-2H3,(H,24,26)
C23H35NO3373.52892100
10047477

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C23H35NO3/c1-21-8-5-14(25)11-13(21)3-4-18-17(21)6-9-22(2)16-7-10-23(18,22)27-20-15(16)12-19(26)24-20/h13-18,20,25H,3-12H2,1-2H3,(H,24,26)/t13-,14+,15-,16+,17-,18+,20-,21-,22?,23+/m0/s1
C23H35NO3373.52892100
10047478

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C23H35NO3/c1-21-8-5-14(25)11-13(21)3-4-18-17(21)6-9-22(2)16-7-10-23(18,22)27-20-15(16)12-19(26)24-20/h13-18,20,25H,3-12H2,1-2H3,(H,24,26)/t13-,14+,15+,16+,17-,18+,20-,21-,22?,23+/m0/s1
C23H35NO3373.52892100
113598630

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C23H35NO3/c1-21-8-5-14(25)11-13(21)3-4-18-17(21)6-9-22(2)16-7-10-23(18,22)27-20-15(16)12-19(26)24-20/h13-18,20,25H,3-12H2,1-2H3,(H,24,26)/t13-,14+,15?,16?,17-,18+,20-,21-,22+,23-/m1/s1
C23H35NO3373.52891100

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