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 4 results

Search term: BQKIHDMASBHRJS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
32512318

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H29NO7/c1-12(8-10-17(24)23-14(3)21(25)29-6)7-9-15-19(27-4)13(2)16-11-30-22(26)18(16)20(15)28-5/h7,14H,8-11H2,1-6H3,(H,23,24)/b12-7+/t14-/m0/s1
C22H29NO7419.46829400
48056323

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H29NO7/c1-12(8-10-17(24)23-14(3)21(25)29-6)7-9-15-19(27-4)13(2)16-11-30-22(26)18(16)20(15)28-5/h7,14H,8-11H2,1-6H3,(H,23,24)/b12-7+
C22H29NO7419.46825400
68035234

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H29NO7/c1-12(8-10-17(24)23-14(3)21(25)29-6)7-9-15-19(27-4)13(2)16-11-30-22(26)18(16)20(15)28-5/h7,14H,8-11H2,1-6H3,(H,23,24)
C22H29NO7419.46821100
68035733

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H29NO7/c1-12(8-10-17(24)23-14(3)21(25)29-6)7-9-15-19(27-4)13(2)16-11-30-22(26)18(16)20(15)28-5/h7,14H,8-11H2,1-6H3,(H,23,24)/t14-/m0/s1
C22H29NO7419.46821100

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