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 6 results

Search term: UNUUCKOLQOHQFO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17463676

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C26H39NO3/c1-19-8-11-23-25(2,13-7-14-26(23,3)24(28)29-4)21(19)10-9-20-12-17-30-22(20)18-27-15-5-6-16-27/h12,17,21,23H,1,5-11,13-16,18H2,2-4H3/t21-,23?,25+,26-/m0/s1
C26H39NO3413.592812900
10049044

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H39NO3/c1-19-8-11-23-25(2,13-7-14-26(23,3)24(28)29-4)21(19)10-9-20-12-17-30-22(20)18-27-15-5-6-16-27/h12,17,21,23H,1,5-11,13-16,18H2,2-4H3/t21-,23-,25+,26-/m0/s1
C26H39NO3413.59282100
3034007

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C26H39NO3/c1-19-8-11-23-25(2,13-7-14-26(23,3)24(28)29-4)21(19)10-9-20-12-17-30-22(20)18-27-15-5-6-16-27/h12,17,21,23H,1,5-11,13-16,18H2,2-4H3
C26H39NO3413.592762100
10049042

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H39NO3/c1-19-8-11-23-25(2,13-7-14-26(23,3)24(28)29-4)21(19)10-9-20-12-17-30-22(20)18-27-15-5-6-16-27/h12,17,21,23H,1,5-11,13-16,18H2,2-4H3/t21-,23+,25+,26-/m0/s1
C26H39NO3413.59282100
10049043

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H39NO3/c1-19-8-11-23-25(2,13-7-14-26(23,3)24(28)29-4)21(19)10-9-20-12-17-30-22(20)18-27-15-5-6-16-27/h12,17,21,23H,1,5-11,13-16,18H2,2-4H3/p+1/t21-,23-,25+,26-/m0/s1
C26H40NO3414.60021100
10049041

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H39NO3/c1-19-8-11-23-25(2,13-7-14-26(23,3)24(28)29-4)21(19)10-9-20-12-17-30-22(20)18-27-15-5-6-16-27/h12,17,21,23H,1,5-11,13-16,18H2,2-4H3/p+1/t21-,23+,25+,26-/m0/s1
C26H40NO3414.60021100

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