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: WTJYDBMHYPQFNJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4446165

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)/b4-2-,12-11+/t14-,15+,16-,17-,19-/m1/s1
C20H32O6368.46448252326
29341999

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)/b4-2-,12-11+/t14-,15-,16-,17-,19-/m1/s1
C20H32O6368.464511900
4947755

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)/b4-2-,12-11+/t14?,15-,16+,17+,19+/m0/s1
C20H32O6368.46455400
2497462

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)/t14-,15+,16-,17-,19-/m1/s1
C20H32O6368.46453200
68899501

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)/b4-2+,12-11u/t14-,15+,16-,17-,19-/m1/s1
C20H32O6368.46453200
1409

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)
C20H32O6368.46452100
8467948

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)/b4-2-,12-11+/t14?,15-,16+,17?,19+/m0/s1
C20H32O6368.46452100
28565445

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)/b4-2+,12-11+
C20H32O6368.46452100
31044487

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)/b4-2+,12-11+/t14-,15+,16-,17-,19-/m1/s1
C20H32O6368.46452100
34948002

Double-bond stereo

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)/b4-2+,12-11+/t14-,15u,16?,17?,19?/m0/s1
C20H32O6368.46451100
68057623

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)/b4-2-,12-11u/t14-,15+,16-,17-,19-/m1/s1
C20H32O6368.46451100
114816430

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)/b4-2+,12-11u/t14-,15-,16+,17-,19-/m1/s1
C20H32O6368.46451100

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