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 27 results

Search term: XJMPAUZQVRGFRE (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
390863

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9-,10-,11-,12+,13-,15+,16+,17-/m1/s1
C17H24O11404.3659403500
21537454

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9+,10-,11+,12-,13+,15+,16-,17+/m0/s1
C17H24O11404.3659161200
90414

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3
C17H24O11404.365971900
161492

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9-,10-,11-,12+,13-,15+,16+,17+/m1/s1
C17H24O11404.36595600
29368598

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9+,10-,11+,12-,13+,15+,16-,17-/m0/s1
C17H24O11404.36595600
26000168

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9-,10?,11-,12+,13-,15+,16+,17-/m1/s1
C17H24O11404.36593100
28658892

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7?,9-,10?,11-,12+,13-,15+,16+,17-/m1/s1
C17H24O11404.36592200
293846

4 of 9 defined stereocentres - 4/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9?,10-,11?,12?,13?,15+,16?,17-/m1/s1
C17H24O11404.36592200
4884708

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9-,10-,11-,12-,13-,15?,16+,17+/m1/s1
C17H24O11404.36592200
62314934

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9+,10+,11-,12-,13-,15-,16-,17+/m1/s1
C17H24O11404.36592200
62563477

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9+,10+,11-,12-,13+,15+,16+,17-/m1/s1
C17H24O11404.36592200
62563478

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9+,10+,11-,12-,13+,15+,16-,17-/m1/s1
C17H24O11404.36592200
62563481

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9+,10-,11-,12-,13-,15+,16-,17+/m1/s1
C17H24O11404.36592200
62563482

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9+,10+,11-,12-,13-,15+,16-,17+/m1/s1
C17H24O11404.36592300
62563487

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9-,10+,11-,12+,13-,15+,16+,17-/m1/s1
C17H24O11404.36592200
62569032

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9+,10+,11-,12-,13+,15-,16+,17-/m1/s1
C17H24O11404.36592200
62569040

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9+,10-,11-,12-,13-,15-,16-,17+/m1/s1
C17H24O11404.36592200
62572071

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9+,10+,11-,12-,13+,15-,16-,17-/m1/s1
C17H24O11404.36592200
82964371

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9-,10-,11-,12+,13-,15+,16+,17-/m0/s1
C17H24O11404.36592100
114826620

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9+,10-,11+,12-,13+,15+,16-,17-/m1/s1
C17H24O11404.36591100
12

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