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 2 results

Search term: AOZGQGIEYSPZKL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4585048

Double-bond stereo

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C45H54N4O8/c1-8-25-23-46-33-21-30-26-13-10-11-14-32(26)47-37(30)29(19-27(25)36(33)38(51)55-6)28-20-31-34(22-35(28)54-5)48(4)40-44(31)16-18-49-17-12-15-43(9-2,39(44)49)41(57-24(3)50)45(40,53)42(52)56-7/h8,10-15,20,22,27,29,33,36,39-41,46-47,53H,9,16-19,21,23H2,1-7H3/b25-8-
C45H54N4O8778.93234400
380641

Double-bond stereo

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C45H54N4O8/c1-8-25-23-46-33-21-30-26-13-10-11-14-32(26)47-37(30)29(19-27(25)36(33)38(51)55-6)28-20-31-34(22-35(28)54-5)48(4)40-44(31)16-18-49-17-12-15-43(9-2,39(44)49)41(57-24(3)50)45(40,53)42(52)56-7/h8,10-15,20,22,27,29,33,36,39-41,46-47,53H,9,16-19,21,23H2,1-7H3
C45H54N4O8778.93232100

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