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 7 results

Search term: QHOCNNVTMIFDFP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9219630

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H18O8/c1-5-9(18-6(2)13)10(19-7(3)14)11(12(16)17-5)20-8(4)15/h5,9-12,16H,1-4H3/t5-,9-,10+,11+,12+/m0/s1
C12H18O8290.26656300
9154333

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C12H18O8/c1-5-9(18-6(2)13)10(19-7(3)14)11(12(16)17-5)20-8(4)15/h5,9-12,16H,1-4H3/t5-,9+,10+,11-,12?/m0/s1
C12H18O8290.26655500
9154334

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C12H18O8/c1-5-9(18-6(2)13)10(19-7(3)14)11(12(16)17-5)20-8(4)15/h5,9-12,16H,1-4H3/t5-,9-,10+,11+,12?/m0/s1
C12H18O8290.26654300
110416249

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H18O8/c1-5-9(18-6(2)13)10(19-7(3)14)11(12(16)17-5)20-8(4)15/h5,9-12,16H,1-4H3/t5-,9-,10+,11-,12+/m1/s1
C12H18O8290.26652300
470153

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C12H18O8/c1-5-9(18-6(2)13)10(19-7(3)14)11(12(16)17-5)20-8(4)15/h5,9-12,16H,1-4H3
C12H18O8290.26652200
114812852

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H18O8/c1-5-9(18-6(2)13)10(19-7(3)14)11(12(16)17-5)20-8(4)15/h5,9-12,16H,1-4H3/t5-,9-,10-,11+,12+/m0/s1
C12H18O8290.26651100
26577462

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C12H18O8/c1-5-9(18-6(2)13)10(19-7(3)14)11(12(16)17-5)20-8(4)15/h5,9-12,16H,1-4H3/t5-,9+,10+,11-,12u/m0/s1
C12H18O8290.26651200

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