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 5 results

Search term: FQNGHHPZIYLPNI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
23254198

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C30H48O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-23,32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21-,22+,23+,27-,28+,29-,30+/m1/s1
C30H48O2440.7009211600
9772139

Double-bond stereo

4 of 8 defined stereocentres - 4/8 defined
InChI=1/C30H48O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-23,32H,9-13,15-19H2,1-7H3/b14-8-/t20-,21-,22?,23?,27-,28+,29?,30?/m1/s1
C30H48O2440.70092100
95532428

Double-bond stereo

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C30H48O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-23,32H,9-13,15-19H2,1-7H3/b14-8+/t20?,21-,22+,23+,27-,28+,29-,30+/m1/s1
C30H48O2440.70091100
113612010

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C30H48O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-23,32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21+,22+,23+,27-,28+,29+,30+/m1/s1
C30H48O2440.70091100
115015402

Double-bond stereo

6 of 8 defined stereocentres - 6/8 defined
InChI=1/C30H48O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-23,32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21?,22+,23+,27-,28+,29-,30?/m1/s1
C30H48O2440.70091100

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