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 23 results

Search term: UXGXCGPWGSUMNI (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4446282

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5-,8-6-,14-10+,15-11+/t18-,19+/m0/s1
C20H32O4336.46568343500
8172747

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5+,8-6+,14-10+,15-11+
C20H32O4336.465762900
28639149

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5-,8-6-,14-10+,15-11+
C20H32O4336.46576700
50645881

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5-,8-6-,14-10+,15-11+/t18-,19-/m0/s1
C20H32O4336.46575400
58164154

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5-,8-6-,14-10+,15-11+/t18-,19-/m1/s1
C20H32O4336.46574500
115040186

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5+,8-6u,14-10u,15-11+
C20H32O4336.46573400
31044555

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5+,8-6+,14-10+,15-11+/t18-,19+/m0/s1
C20H32O4336.46573100
23177613

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5-,8-6-,14-10+,15-11+/t18-,19?/m0/s1
C20H32O4336.46573300
23353248

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)
C20H32O4336.46572100
107562542

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5+,8-6u,14-10u,15-11+/t18-,19+/m0/s1
C20H32O4336.46572100
58183729

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5+,8-6+,14-10u,15-11+/t18-,19+/m0/s1
C20H32O4336.46572100
59664396

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5-,8-6-,14-10u,15-11+/t18-,19-/m1/s1
C20H32O4336.46572300
68057628

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5-,8-6-,14-10+,15-11u/t18-,19+/m0/s1
C20H32O4336.46571100
74849616

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5u,8-6+,14-10+,15-11+
C20H32O4336.46571100
111311840

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5-,8-6-,14-10+,15-11+/t18-,19+/m1/s1
C20H32O4336.46571100
128529188

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5u,8-6u,14-10+,15-11+
C20H32O4336.46571100
58164091

Charge

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/p-1/b7-5-,8-6-,14-10+,15-11+/t18-,19-/m1/s1
C20H31O4335.45831100
58164092

Charge

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/p-1/b7-5-,8-6-,14-10+,15-11+/t18-,19+/m0/s1
C20H31O4335.45831100
12

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