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 11 results

Search term: XJSSRXITQUJZLO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
432675

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C20H32O3/c1-17-8-4-9-18(2,16(21)22)14(17)7-10-20-11-13(5-6-15(17)20)19(3,23)12-20/h13-15,23H,4-12H2,1-3H3,(H,21,22)
C20H32O3320.46636600
141765

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O3/c1-17-8-4-9-18(2,16(21)22)14(17)7-10-20-11-13(5-6-15(17)20)19(3,23)12-20/h13-15,23H,4-12H2,1-3H3,(H,21,22)/t13-,14-,15-,17+,18+,19+,20-/m0/s1
C20H32O3320.46634400
4572878

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C20H32O3/c1-17-8-4-9-18(2,16(21)22)14(17)7-10-20-11-13(5-6-15(17)20)19(3,23)12-20/h13-15,23H,4-12H2,1-3H3,(H,21,22)/t13?,14-,15-,17+,18+,19+,20-/m0/s1
C20H32O3320.46633300
24653429

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C20H32O3/c1-17-8-4-9-18(2,16(21)22)14(17)7-10-20-11-13(5-6-15(17)20)19(3,23)12-20/h13-15,23H,4-12H2,1-3H3,(H,21,22)/t13-,14+,15+,17-,18-,19-,20+/m1/s1
C20H32O3320.46633400
30809626

5 of 7 defined stereocentres - 5/7 defined
InChI=1/C20H32O3/c1-17-8-4-9-18(2,16(21)22)14(17)7-10-20-11-13(5-6-15(17)20)19(3,23)12-20/h13-15,23H,4-12H2,1-3H3,(H,21,22)/t13-,14?,15?,17-,18-,19-,20+/m1/s1
C20H32O3320.46633300
24698799

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O3/c1-17-8-4-9-18(2,16(21)22)14(17)7-10-20-11-13(5-6-15(17)20)19(3,23)12-20/h13-15,23H,4-12H2,1-3H3,(H,21,22)/t13-,14-,15+,17-,18-,19-,20+/m1/s1
C20H32O3320.46632200
26344017

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O3/c1-17-8-4-9-18(2,16(21)22)14(17)7-10-20-11-13(5-6-15(17)20)19(3,23)12-20/h13-15,23H,4-12H2,1-3H3,(H,21,22)/t13-,14+,15+,17-,18-,19+,20+/m1/s1
C20H32O3320.46632200
10143051

3 of 7 defined stereocentres - 3/7 defined
InChI=1/C20H32O3/c1-17-8-4-9-18(2,16(21)22)14(17)7-10-20-11-13(5-6-15(17)20)19(3,23)12-20/h13-15,23H,4-12H2,1-3H3,(H,21,22)/t13?,14-,15-,17?,18?,19+,20?/m0/s1
C20H32O3320.46632200
19989161

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O3/c1-17-8-4-9-18(2,16(21)22)14(17)7-10-20-11-13(5-6-15(17)20)19(3,23)12-20/h13-15,23H,4-12H2,1-3H3,(H,21,22)/t13-,14+,15+,17-,18-,19-,20+/m0/s1
C20H32O3320.46632200
23270691

4 of 7 defined stereocentres - 4/7 defined
InChI=1/C20H32O3/c1-17-8-4-9-18(2,16(21)22)14(17)7-10-20-11-13(5-6-15(17)20)19(3,23)12-20/h13-15,23H,4-12H2,1-3H3,(H,21,22)/t13?,14?,15?,17-,18-,19-,20+/m1/s1
C20H32O3320.466282200
58842194

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O3/c1-17-8-4-9-18(2,16(21)22)14(17)7-10-20-11-13(5-6-15(17)20)19(3,23)12-20/h13-15,23H,4-12H2,1-3H3,(H,21,22)/t13-,14-,15-,17-,18-,19+,20+/m0/s1
C20H32O3320.46631100

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