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 37 results

Search term: XYPPDQHBNJURHU (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5417062

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15+,16+,17+,18+,19+,20-/m1/s1
C20H36O5356.4968171600
5140873

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15?,16+,17+,18+,19+,20-/m1/s1
C20H36O5356.4968161000
21825586

5 of 7 defined stereocentres - 5/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15?,16+,17+,18+,19?,20+/m1/s1
C20H36O5356.4968141200
20473419

5 of 7 defined stereocentres - 5/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15?,16+,17+,18+,19?,20-/m1/s1
C20H36O5356.496810800
22883624

5 of 7 defined stereocentres - 5/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15?,16-,17-,18-,19?,20+/m0/s1
C20H36O5356.49689500
2723774

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3
C20H36O5356.4968481200
17981581

2 of 7 defined stereocentres - 2/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14?,15?,16?,17-,18-,19?,20?/m0/s1
C20H36O5356.49687400
6138487

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15-,16-,17-,18-,19-,20+/m0/s1
C20H36O5356.49683200
6138488

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15+,16-,17-,18-,19-,20+/m0/s1
C20H36O5356.49683200
5566669

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15-,16+,17+,18-,19-,20+/m1/s1
C20H36O5356.49683200
5664320

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15+,16+,17+,18+,19-,20-/m1/s1
C20H36O5356.49683300
5664321

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15-,16-,17-,18-,19+,20+/m0/s1
C20H36O5356.49683200
5392662

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15+,16-,17-,18-,19+,20+/m0/s1
C20H36O5356.49683200
5417063

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15-,16+,17+,18+,19+,20-/m1/s1
C20H36O5356.49683200
5566666

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15+,16+,17+,18+,19-,20+/m1/s1
C20H36O5356.49683200
5566667

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15-,16+,17+,18+,19-,20+/m1/s1
C20H36O5356.49682100
5566668

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15+,16+,17+,18-,19-,20+/m1/s1
C20H36O5356.49682100
1379507

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15-,16+,17+,18-,19+,20-/m0/s1
C20H36O5356.49682100
1379508

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15+,16+,17+,18-,19+,20-/m0/s1
C20H36O5356.49682100
5664322

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14-,15-,16+,17+,18+,19-,20-/m1/s1
C20H36O5356.49682100
12

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