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 14 results

Search term: RIVQQZVHIVNQFH (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
141053

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C27H48O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-25,28-30H,6-15H2,1-5H3/t17-,18+,19-,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1
C27H48O3420.6682354300
4447375

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C27H48O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-25,28-30H,6-15H2,1-5H3/t17-,18-,19-,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1
C27H48O3420.6682200000013420
23977056

4 of 11 defined stereocentres - 4/11 defined
InChI=1/C27H48O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-25,28-30H,6-15H2,1-5H3/t17?,18-,19?,20?,21?,22?,23?,24?,25-,26-,27+/m0/s1
C27H48O3420.66822100
58784283

11 of 11 defined stereocentres - 11/11 defined

Non-standard isotope
InChI=1/C27H48O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-25,28-30H,6-15H2,1-5H3/t17-,18+,19-,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1/i1D3,2D3,16D
C27H41D7O3427.71142500
111309468

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C27H48O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-25,28-30H,6-15H2,1-5H3/t17-,18-,19+,20+,21-,22-,23+,24-,25-,26-,27+/m1/s1
C27H48O3420.66821100
111310116

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C27H48O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-25,28-30H,6-15H2,1-5H3/t17-,18-,19-,20-,21+,22+,23-,24+,25-,26-,27+/m1/s1
C27H48O3420.66821100
111313232

10 of 11 defined stereocentres - 10/11 defined

Non-standard isotope
InChI=1/C27H48O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-25,28-30H,6-15H2,1-5H3/t17-,18+,19-,20-,21+,22+,23-,24+,25?,26+,27-/m1/s1/i1D3,2D3,16D
C27H41D7O3427.71141100
113618534

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C27H48O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-25,28-30H,6-15H2,1-5H3/t17-,18-,19+,20+,21-,22-,23+,24-,25-,26-,27+/m0/s1
C27H48O3420.66821100
19988959

8 of 11 defined stereocentres - 8/11 defined
InChI=1/C27H48O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-25,28-30H,6-15H2,1-5H3/t17-,18+,19?,20-,21+,22+,23?,24?,25+,26+,27-/m1/s1
C27H48O3420.66821100

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