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 17 results

Search term: FFPUNPBUZDTHJI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
215388

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17-,18-,19+,20+,21+/m1/s1
C21H36O5368.5075404400
216069

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17+,18-,19+,20+,21+/m1/s1
C21H36O5368.50754041104
432361

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3
C21H36O5368.507561400
389578

2 of 10 defined stereocentres - 2/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12?,13-,14?,15?,16?,17?,18?,19?,20?,21+/m1/s1
C21H36O5368.50755300
4932527

6 of 10 defined stereocentres - 6/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14?,15?,16+,17?,18?,19+,20+,21+/m1/s1
C21H36O5368.50754500
34994930

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14-,15-,16-,17+,18+,19-,20-,21-/m0/s1
C21H36O5368.50754500
77499350

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17+,18?,19+,20+,21-/m1/s1
C21H36O5368.50753200
62429745

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13+,14+,15+,16-,17-,18-,19+,20+,21+/m0/s1
C21H36O5368.50752200
62673774

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13+,14+,15+,16-,17+,18-,19+,20+,21+/m0/s1
C21H36O5368.50752200
58817353

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17+,18-,19?,20?,21+/m1/s1
C21H36O5368.50751100
58818016

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17-,18-,19?,20?,21+/m1/s1
C21H36O5368.50751100
16735648

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14-,15-,16-,17?,18+,19-,20-,21-/m0/s1
C21H36O5368.50751105
107443060

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17+,18-,19+,20+,21-/m1/s1
C21H36O5368.50751300
113385450

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,17-,18+,19-,20-,21-/m0/s1
C21H36O5368.50751100
113385451

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,17+,18+,19-,20-,21-/m0/s1
C21H36O5368.50751100
114553758

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17-,18-,19+,20+,21+/m0/s1
C21H36O5368.50751100

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