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 7 results

Search term: GQVCGTRDXSDAHC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
29215786

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3/b9-8+/t19-,20+,21-,23+,24-,25-,26+,27+,28+,29-/m0/s1
C29H48O3444.6896252400
57576786

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3/t19-,20+,21-,23+,24-,25-,26+,27+,28+,29-/m0/s1
C29H48O3444.68963200
29214136

Double-bond stereo

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3/b9-8+/t19?,20-,21+,23-,24+,25+,26-,27-,28-,29+/m1/s1
C29H48O3444.68963300
4976980

Double-bond stereo

7 of 10 defined stereocentres - 7/10 defined
InChI=1/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3/b9-8+/t19?,20-,21+,23-,24?,25?,26-,27-,28-,29+/m1/s1
C29H48O3444.68962200
9707154

Double-bond stereo

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3/b9-8+/t19-,20+,21-,23+,24?,25?,26+,27+,28+,29-/m0/s1
C29H48O3444.68962100
26646308

Double-bond stereo

7 of 10 defined stereocentres - 7/10 defined
InChI=1/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3/b9-8+/t19?,20?,21-,23+,24?,25-,26+,27+,28+,29-/m0/s1
C29H48O3444.68962200
113611890

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3/b9-8+/t19-,20+,21-,23-,24-,25+,26+,27+,28-,29-/m0/s1
C29H48O3444.68961100

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