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 129 results

Search term: PIYNPBVOTLQBTC (Found by InChIKey (skeleton match))
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
32699351

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3
C29H40O6484.62432300
34989858

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24-,25-,26-,27-,28+,29-/m1/s1
C29H40O6484.62431100
34989859

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24-,25-,26-,27-,28+,29-/m0/s1
C29H40O6484.62431100
34989860

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24-,25-,26-,27-,28-,29-/m1/s1
C29H40O6484.62431100
34989861

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24+,25-,26+,27-,28-,29-/m1/s1
C29H40O6484.62431100
34989862

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24-,25-,26-,27-,28-,29-/m0/s1
C29H40O6484.62431100
34989863

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24-,25-,26-,27-,28+,29+/m1/s1
C29H40O6484.62431100
34989864

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24-,25-,26-,27-,28+,29+/m0/s1
C29H40O6484.62431100
34989865

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24-,25-,26-,27-,28-,29+/m1/s1
C29H40O6484.62431100
34989866

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24-,25-,26-,27-,28-,29+/m0/s1
C29H40O6484.62431100
34989867

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24+,25-,26-,27-,28-,29+/m0/s1
C29H40O6484.62431100
34989868

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24+,25-,26-,27-,28-,29+/m1/s1
C29H40O6484.62431100
34989869

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24+,25-,26-,27-,28+,29+/m0/s1
C29H40O6484.62431100
34989870

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24+,25-,26-,27-,28+,29+/m1/s1
C29H40O6484.62431100
34989871

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24+,25-,26-,27-,28-,29-/m0/s1
C29H40O6484.62431100
34989872

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24+,25-,26+,27-,28+,29-/m0/s1
C29H40O6484.62431100
34989873

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24+,25-,26-,27-,28-,29-/m1/s1
C29H40O6484.62431100
34989874

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24+,25-,26-,27-,28+,29-/m0/s1
C29H40O6484.62431100
34989875

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24+,25-,26-,27-,28+,29-/m1/s1
C29H40O6484.62431100
34989876

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C29H40O6/c1-4-7-19-10-14-21(15-11-19)28-32-24(9-6-3)26-27(35-28)25(23(31)18-30)33-29(34-26)22-16-12-20(8-5-2)13-17-22/h10-17,23-31H,4-9,18H2,1-3H3/t23-,24-,25+,26+,27+,28+,29-/m1/s1
C29H40O6484.62431100
12345

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