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
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Found 2 results

Search term: KTJPPZDEEJQRMF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8517571

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C29H40O2/c1-20(10-7-8-16-28(3,4)5)25-14-15-26-22(11-9-17-29(25,26)6)12-13-23-18-24(30)19-27(31)21(23)2/h12-13,20,24-27,30-31H,2,9,11,14-15,17-19H2,1,3-6H3/b22-12+,23-13-/t20-,24+,25+,26-,27-,29+/m0/s1
C29H40O2420.62672100
8540297

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C29H40O2/c1-20(10-7-8-16-28(3,4)5)25-14-15-26-22(11-9-17-29(25,26)6)12-13-23-18-24(30)19-27(31)21(23)2/h12-13,20,24-27,30-31H,2,9,11,14-15,17-19H2,1,3-6H3/b22-12+,23-13-/t20-,24-,25-,26+,27+,29-/m1/s1
C29H40O2420.62672100

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